1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-piperidine-4-carboxamide

Systemtic Name: 1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-piperidine-4-carboxamide Openeye Name: 1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-piperidine-4-carboxamide CAS Name: 1-[3-[4-(1-azepanylsulfonyl)phenyl]-1-oxopropyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methylpiperidine-4-carboxamide Traditional Name: 1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-isonipecotamide Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CCN(CC1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CNC(=O)C1CCN(CC1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H33N3O4S/c1-23-22(27)19-12-16-24(17-13-19)21(26)11-8-18-6-9-20(10-7-18)30(28,29)25-14-4-2-3-5-15-25/h6-7,9-10,19H,2-5,8,11-17H2,1H3,(H,23,27)