3-methyl-N-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]but-2-enamide

Systemtic Name: 3-methyl-N-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]but-2-enamide Openeye Name: 3-methyl-N-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3-pyridyl]but-2-enamide CAS Name: 3-methyl-N-[6-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-pyridinyl]-2-butenamide IUPAC Name: 3-methyl-N-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]pyridin-3-yl]but-2-enamide Traditional Name: 3-methyl-N-[6-[4-(2-thenoyl)piperazino]-3-pyridyl]but-2-enamide Formula: C19H22N4O2S MolecularWeight: 370.46858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CC(=CC(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C19H22N4O2S/c1-14(2)12-18(24)21-15-5-6-17(20-13-15)22-7-9-23(10-8-22)19(25)16-4-3-11-26-16/h3-6,11-13H,7-10H2,1-2H3,(H,21,24)