3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)pyridin-4-one

Systemtic Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)pyridin-4-one Openeye Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-ethyl-6-methyl-1-(2-thienylmethyl)pyridin-4-one CAS Name: 3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)-4-pyridinone IUPAC Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)pyridin-4-one Traditional Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-ethyl-6-methyl-1-(2-thenyl)-4-pyridone Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O2S/c1-5-22-25(24(30)16-20(4)29(22)17-21-7-6-14-32-21)26(31)28-12-10-27(11-13-28)23-15-18(2)8-9-19(23)3/h6-9,14-16H,5,10-13,17H2,1-4H3