3-(2-cyclohexylethyl)-4-[(Z)-(phenylmethylidene)amino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-cyclohexylethyl)-4-[(Z)-(phenylmethylidene)amino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(Z)-benzylideneamino]-3-(2-cyclohexylethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-cyclohexylethyl)-4-[(Z)-(phenylmethylene)amino]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(Z)-benzylideneamino]-3-(2-cyclohexylethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(Z)-benzalamino]-3-(2-cyclohexylethyl)-1H-1,2,4-triazole-5-thione Formula: C17H22N4S MolecularWeight: 314.44838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4S/c22-17-20-19-16(12-11-14-7-3-1-4-8-14)21(17)18-13-15-9-5-2-6-10-15/h2,5-6,9-10,13-14H,1,3-4,7-8,11-12H2,(H,20,22)/b18-13-