3-(2-cyclohexylethyl)-4-[(Z)-(1-phenylpyrazol-4-yl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-cyclohexylethyl)-4-[(Z)-(1-phenylpyrazol-4-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-cyclohexylethyl)-4-[(Z)-(1-phenylpyrazol-4-yl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-cyclohexylethyl)-4-[(Z)-(1-phenyl-4-pyrazolyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-cyclohexylethyl)-4-[(Z)-(1-phenylpyrazol-4-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-cyclohexylethyl)-4-[(Z)-(1-phenylpyrazol-4-yl)methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C20H24N6S MolecularWeight: 380.50976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2=NNC(=S)N2N=CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CCC2=NNC(=S)N2/N=C\C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N6S/c27-20-24-23-19(12-11-16-7-3-1-4-8-16)26(20)22-14-17-13-21-25(15-17)18-9-5-2-6-10-18/h2,5-6,9-10,13-16H,1,3-4,7-8,11-12H2,(H,24,27)/b22-14-