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

Systemtic Name: 3-(2-cyclohexylethyl)-4-[(Z)-pyridin-3-ylmethylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-cyclohexylethyl)-4-[(Z)-3-pyridylmethyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-cyclohexylethyl)-4-[(Z)-3-pyridinylmethylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-cyclohexylethyl)-4-[(Z)-pyridin-3-ylmethylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-cyclohexylethyl)-4-[(Z)-3-pyridylmethyleneamino]-1H-1,2,4-triazole-5-thione Formula: C16H21N5S MolecularWeight: 315.43644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5S/c22-16-20-19-15(9-8-13-5-2-1-3-6-13)21(16)18-12-14-7-4-10-17-11-14/h4,7,10-13H,1-3,5-6,8-9H2,(H,20,22)/b18-12-