1-(azepan-1-ylsulfonyl)-N-(4-phenylbutan-2-yl)piperidine-3-carboxamide

Systemtic Name: 1-(azepan-1-ylsulfonyl)-N-(4-phenylbutan-2-yl)piperidine-3-carboxamide Openeye Name: 1-(azepan-1-ylsulfonyl)-N-(1-methyl-3-phenyl-propyl)piperidine-3-carboxamide CAS Name: 1-(1-azepanylsulfonyl)-N-(4-phenylbutan-2-yl)-3-piperidinecarboxamide IUPAC Name: 1-(azepan-1-ylsulfonyl)-N-(4-phenylbutan-2-yl)piperidine-3-carboxamide Traditional Name: 1-(azepan-1-ylsulfonyl)-N-(1-methyl-3-phenyl-propyl)nipecotamide Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H35N3O3S/c1-19(13-14-20-10-5-4-6-11-20)23-22(26)21-12-9-17-25(18-21)29(27,28)24-15-7-2-3-8-16-24/h4-6,10-11,19,21H,2-3,7-9,12-18H2,1H3,(H,23,26)