N-[2-(azepan-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]cyclopentanecarboxamide

Systemtic Name: N-[2-(azepan-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]cyclopentanecarboxamide Openeye Name: N-[2-(azepan-1-yl)-5-(1-piperidylsulfonyl)phenyl]cyclopentanecarboxamide CAS Name: N-[2-(1-azepanyl)-5-(1-piperidinylsulfonyl)phenyl]cyclopentanecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-piperidin-1-ylsulfonylphenyl]cyclopentanecarboxamide Traditional Name: N-[2-(azepan-1-yl)-5-piperidinosulfonyl-phenyl]cyclopentanecarboxamide Formula: C23H35N3O3S MolecularWeight: 433.6073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)C4CCCC4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)C4CCCC4

InChI

InChI=1S/C23H35N3O3S/c27-23(19-10-4-5-11-19)24-21-18-20(30(28,29)26-16-8-3-9-17-26)12-13-22(21)25-14-6-1-2-7-15-25/h12-13,18-19H,1-11,14-17H2,(H,24,27)