2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-quinazolin-4-one CAS Name: 2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylthio]-1H-quinazolin-4-one IUPAC Name: 2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methylthio]-1H-quinazolin-4-one Formula: C17H13N5OS2 MolecularWeight: 367.44802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C17H13N5OS2/c23-15-12-8-4-5-9-13(12)18-16(19-15)25-10-14-20-21-17(24)22(14)11-6-2-1-3-7-11/h1-9H,10H2,(H,21,24)(H,18,19,23)