2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide

Base Information

• Chemical Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide
• CAS No.: 5637-43-4
• Molecular Formula: C15H15N5O3S
• DSSTox Substance ID: DTXSID70417005

Synonyms:5637-43-4;2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide;AC1NSY6B;DTXSID70417005;AKOS024331203;BIM-0026786.P001;2-(DIMETHYL-PYRIMIDIN-2-YLSULFANYL)-ACETIC ACID (4-NITRO-BENZYLIDENE)-HYDRAZIDE

Chemical Property of 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 345.08956053
• Heavy Atom Count: 24
• Complexity: 453

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC=C(C=C2)[N+](=O)[O-])C
• Isomeric SMILES: CC1=CC(=NC(=N1)SCC(=O)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-])C

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