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

Systemtic Name: 4-[(Z)-[3-(2-cyclohexylethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzenecarbonitrile Openeye Name: 4-[(Z)-[3-(2-cyclohexylethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile CAS Name: 4-[(Z)-[3-(2-cyclohexylethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile IUPAC Name: 4-[(Z)-[3-(2-cyclohexylethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile Traditional Name: 4-[(Z)-[3-(2-cyclohexylethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]benzonitrile Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2=NNC(=S)N2N=CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCC(CC1)CCC2=NNC(=S)N2/N=C\C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H21N5S/c19-12-15-6-8-16(9-7-15)13-20-23-17(21-22-18(23)24)11-10-14-4-2-1-3-5-14/h6-9,13-14H,1-5,10-11H2,(H,22,24)/b20-13-