5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(phenethylcarbamoyl)phenyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(phenethylcarbamoyl)phenyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(phenethylcarbamoyl)phenyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methyl-N-[2-[oxo-(phenethylamino)methyl]phenyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(phenethylcarbamoyl)phenyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(phenethylcarbamoyl)phenyl]benzamide Formula: C29H33N3O4S MolecularWeight: 519.65502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C29H33N3O4S/c1-22-15-16-24(37(35,36)32-19-9-2-3-10-20-32)21-26(22)29(34)31-27-14-8-7-13-25(27)28(33)30-18-17-23-11-5-4-6-12-23/h4-8,11-16,21H,2-3,9-10,17-20H2,1H3,(H,30,33)(H,31,34)