3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethyl-6-methyl-phenyl)propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethyl-6-methyl-phenyl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethyl-6-methyl-phenyl)propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-(2-ethyl-6-methylphenyl)propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethyl-6-methylphenyl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethyl-6-methyl-phenyl)propionamide Formula: C24H32N2O3S MolecularWeight: 428.58748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C24H32N2O3S/c1-3-21-10-8-9-19(2)24(21)25-23(27)16-13-20-11-14-22(15-12-20)30(28,29)26-17-6-4-5-7-18-26/h8-12,14-15H,3-7,13,16-18H2,1-2H3,(H,25,27)