3-[1-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[1-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[1-[(4-benzhydrylpiperazin-1-yl)methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[1-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[1-[(4-benzhydrylpiperazin-1-yl)methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[1-[(4-benzhydrylpiperazino)methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C24H30N6OS MolecularWeight: 450.5996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)CCC(=O)N

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)CCC(=O)N

InChI

InChI=1S/C24H30N6OS/c1-27-22(13-12-21(25)31)26-30(24(27)32)18-28-14-16-29(17-15-28)23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,23H,12-18H2,1H3,(H2,25,31)