2-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-methyl-N-[3-(2-oxo-1-azepanyl)propyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C22H33N3O4S MolecularWeight: 435.58012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCCN3CCCCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCCN3CCCCCC3=O

InChI

InChI=1S/C22H33N3O4S/c1-18-10-11-19(30(28,29)25-15-6-3-7-16-25)17-20(18)22(27)23-12-8-14-24-13-5-2-4-9-21(24)26/h10-11,17H,2-9,12-16H2,1H3,(H,23,27)