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

Systemtic Name: 4-[(Z)-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzenecarbonitrile Openeye Name: 4-[(Z)-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile CAS Name: 4-[(Z)-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile IUPAC Name: 4-[(Z)-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile Traditional Name: 4-[(Z)-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]benzonitrile Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2/N=C\C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H15N5OS/c1-2-24-16-9-7-15(8-10-16)17-21-22-18(25)23(17)20-12-14-5-3-13(11-19)4-6-14/h3-10,12H,2H2,1H3,(H,22,25)/b20-12-