N-[3-(azepan-1-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-1-[(1-methyl-5-indolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-1-(1-methylindol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-nipecotamide Formula: C24H36N4O3S MolecularWeight: 460.63264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCCCCC4

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCCCCC4

InChI

InChI=1S/C24H36N4O3S/c1-26-17-11-20-18-22(9-10-23(20)26)32(30,31)28-16-6-8-21(19-28)24(29)25-12-7-15-27-13-4-2-3-5-14-27/h9-11,17-18,21H,2-8,12-16,19H2,1H3,(H,25,29)