N-[2-(azepan-1-yl)ethyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(1-azepanyl)ethyl]-1-[(1-methyl-5-indolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-1-(1-methylindol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-1-(1-methylindol-5-yl)sulfonyl-nipecotamide Formula: C23H34N4O3S MolecularWeight: 446.60606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCN4CCCCCC4

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCN4CCCCCC4

InChI

InChI=1S/C23H34N4O3S/c1-25-15-10-19-17-21(8-9-22(19)25)31(29,30)27-14-6-7-20(18-27)23(28)24-11-16-26-12-4-2-3-5-13-26/h8-10,15,17,20H,2-7,11-14,16,18H2,1H3,(H,24,28)