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

Systemtic Name: 3-[1-[[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[1-[[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[1-[[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[1-[[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[1-[[4-(benzothiophen-3-ylmethyl)piperazino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C20H26N6OS2 MolecularWeight: 430.59004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)CC3=CSC4=CC=CC=C43)CCC(=O)N

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)CC3=CSC4=CC=CC=C43)CCC(=O)N

InChI

InChI=1S/C20H26N6OS2/c1-23-19(7-6-18(21)27)22-26(20(23)28)14-25-10-8-24(9-11-25)12-15-13-29-17-5-3-2-4-16(15)17/h2-5,13H,6-12,14H2,1H3,(H2,21,27)