2-[4-[[4-(3-methylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[[4-(3-methylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[[4-(m-tolyl)-3-phenyl-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[[4-(3-methylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-[[4-(3-methylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-[[4-(m-tolyl)-3-phenyl-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]-N-propyl-acetamide Formula: C25H32N6OS MolecularWeight: 464.62618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C4=CC=CC(=C4)C

Isomeric SMILES

CCCNC(=O)CN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C4=CC=CC(=C4)C

InChI

InChI=1S/C25H32N6OS/c1-3-12-26-23(32)18-28-13-15-29(16-14-28)19-30-25(33)31(22-11-7-8-20(2)17-22)24(27-30)21-9-5-4-6-10-21/h4-11,17H,3,12-16,18-19H2,1-2H3,(H,26,32)