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

Systemtic Name: 2-ethyl-6-methyl-3-[(4S)-4-phenylazepan-1-yl]carbonyl-1-(thiophen-2-ylmethyl)pyridin-4-one Openeye Name: 2-ethyl-6-methyl-3-[(4S)-4-phenylazepane-1-carbonyl]-1-(2-thienylmethyl)pyridin-4-one CAS Name: 2-ethyl-6-methyl-3-[oxo-[(4S)-4-phenyl-1-azepanyl]methyl]-1-(thiophen-2-ylmethyl)-4-pyridinone IUPAC Name: 2-ethyl-6-methyl-3-[(4S)-4-phenylazepane-1-carbonyl]-1-(thiophen-2-ylmethyl)pyridin-4-one Traditional Name: 2-ethyl-6-methyl-3-[(4S)-4-phenylazepane-1-carbonyl]-1-(2-thenyl)-4-pyridone Formula: C26H30N2O2S MolecularWeight: 434.5936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)N3CCCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)N3CCC[C@@H](CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O2S/c1-3-23-25(24(29)17-19(2)28(23)18-22-12-8-16-31-22)26(30)27-14-7-11-21(13-15-27)20-9-5-4-6-10-20/h4-6,8-10,12,16-17,21H,3,7,11,13-15,18H2,1-2H3/t21-/m0/s1