4-[(Z)-[3-(phenylmethylsulfanyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-[3-(phenylmethylsulfanyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzenecarbonitrile Openeye Name: 4-[(Z)-(3-benzylsulfanyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]benzonitrile CAS Name: 4-[(Z)-[3-(phenylmethylthio)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile IUPAC Name: 4-[(Z)-(3-benzylsulfanyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]benzonitrile Traditional Name: 4-[(Z)-[3-(benzylthio)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile Formula: C17H13N5S2 MolecularWeight: 351.44862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NNC(=S)N2N=CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NNC(=S)N2/N=C\C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H13N5S2/c18-10-13-6-8-14(9-7-13)11-19-22-16(23)20-21-17(22)24-12-15-4-2-1-3-5-15/h1-9,11H,12H2,(H,20,23)/b19-11-