2-(azepan-1-yl)-N-[3-(2-methylphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-[3-(2-methylphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide Openeye Name: 2-(azepan-1-yl)-N-[3-(2-methylbenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]acetamide CAS Name: 2-(1-azepanyl)-N-[3-[(2-methylphenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-[3-(2-methylbenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide Traditional Name: 2-(azepan-1-yl)-N-(3-o-toluoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C24H30N2O2S MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4CCCCCC4

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4CCCCCC4

InChI

InChI=1S/C24H30N2O2S/c1-17-10-4-5-11-18(17)23(28)22-19-12-6-7-13-20(19)29-24(22)25-21(27)16-26-14-8-2-3-9-15-26/h4-5,10-11H,2-3,6-9,12-16H2,1H3,(H,25,27)