2-ethyl-6-methyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1-(thiophen-2-ylmethyl)pyridin-4-one

Systemtic Name: 2-ethyl-6-methyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1-(thiophen-2-ylmethyl)pyridin-4-one Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-2-ethyl-6-methyl-1-(2-thienylmethyl)pyridin-4-one CAS Name: 2-ethyl-6-methyl-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-(thiophen-2-ylmethyl)-4-pyridinone IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)pyridin-4-one Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-2-ethyl-6-methyl-1-(2-thenyl)-4-pyridone Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2S/c1-3-22-24(23(29)16-19(2)28(22)18-21-10-7-15-31-21)25(30)27-13-11-26(12-14-27)17-20-8-5-4-6-9-20/h4-10,15-16H,3,11-14,17-18H2,1-2H3