3-methoxy-N-[[3-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide

Base Information

• Chemical Name: 3-methoxy-N-[[3-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide
• CAS No.: 5337-21-3
• Molecular Formula: C22H16N6O2S2
• Molecular Weight: 460.5
• DSSTox Substance ID: DTXSID50410195
• Wikidata: Q82216289

Synonyms:5337-21-3;3-methoxy-N-[[3-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide;DTXSID50410195

Chemical Property of 3-methoxy-N-[[3-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide

Chemical Property:

• XLogP3: 4.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 460.07761612
• Heavy Atom Count: 32
• Complexity: 699

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• Canonical SMILES: COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC=CC(=C3)C4=NN5C=NN=C5S4

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