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Cas Database |
| Name |
Perospirone |
EINECS | N/A |
| CAS No. | 150915-41-6 | Density | N/A |
| PSA | 84.99000 | LogP | 3.31450 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C23H30N4O2S | Boiling Point | N/A |
| Molecular Weight | 426.583 | Flash Point | N/A |
| Transport Information | N/A | Appearance | White powder |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1H-Isoindole-1,3(2H)-dione,2-[4-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]butyl]hexahydro-, cis-;Lullan;1H-Isoindole-1,3(2H)-dione,2-[4-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]butyl]hexahydro-,(3aR,7aS)-rel-;cis-N-[4-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]butyl]-1,2-cyclohexanedicarboximide;Perospirone [INN];UNII-N303OK87DT;(3aR,7aS)-2-[4-[4-(1,2-Benzothiazol-3-yl)piperazin-1-yl]butyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione; |
Article Data | 2 |
Perospirone Specification
The Perospirone, with the CAS registry number 150915-41-6, is also known as cis-N-[4-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]butyl]-1,2-cyclohexanedicarboximide. This chemical's molecular formula is C23H30N4O2S and molecular weight is 426.57. What's more, its IUPAC name is (3aR,7aS)-2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione. Its classification code is Neuroleptic. Perospirone (Lullan) is an atypical antipsychotic of the azapirone chemical class.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC2C(C1)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NSC5=CC=CC=C54
(2)Isomeric SMILES: C1CC[C@H]2[C@@H](C1)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NSC5=CC=CC=C54
(3)InChI: InChI=1S/C23H30N4O2S/c28-22-17-7-1-2-8-18(17)23(29)27(22)12-6-5-11-25-13-15-26(16-14-25)21-19-9-3-4-10-20(19)30-24-21/h3-4,9-10,17-18H,1-2,5-8,11-16H2/t17-,18+
(4)InChIKey: FBVFZWUMDDXLLG-HDICACEKSA-N
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