N-(2-acetamidoethyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide

Systemtic Name: N-(2-acetamidoethyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide Openeye Name: N-(2-acetamidoethyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide CAS Name: N-(2-acetamidoethyl)-3-[4-(1-azepanylsulfonyl)phenyl]propanamide IUPAC Name: N-(2-acetamidoethyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide Traditional Name: N-(2-acetamidoethyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propionamide Formula: C19H29N3O4S MolecularWeight: 395.51626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC(=O)NCCNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C19H29N3O4S/c1-16(23)20-12-13-21-19(24)11-8-17-6-9-18(10-7-17)27(25,26)22-14-4-2-3-5-15-22/h6-7,9-10H,2-5,8,11-15H2,1H3,(H,20,23)(H,21,24)