2-methylsulfanyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]pyridine-3-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-2-(methylthio)nicotinamide Formula: C25H30N4OS2 MolecularWeight: 466.6619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=C(N=CC=C4)SC

Isomeric SMILES

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=C(N=CC=C4)SC

InChI

InChI=1S/C25H30N4OS2/c1-19(27-24(30)21-10-6-12-26-25(21)31-2)23(22-11-7-17-32-22)29-15-13-28(14-16-29)18-20-8-4-3-5-9-20/h3-12,17,19,23H,13-16,18H2,1-2H3,(H,27,30)