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

Systemtic Name: N-[3-(azepan-1-yl)propyl]-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-1-[(3,5-dimethyl-1-piperidyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-1-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-(3,5-dimethylpiperidino)sulfonyl-nipecotamide Formula: C22H42N4O3S MolecularWeight: 442.65888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCN3CCCCCC3)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCN3CCCCCC3)C

InChI

InChI=1S/C22H42N4O3S/c1-19-15-20(2)17-26(16-19)30(28,29)25-14-7-9-21(18-25)22(27)23-10-8-13-24-11-5-3-4-6-12-24/h19-21H,3-18H2,1-2H3,(H,23,27)