5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[2-(3-methoxypropylcarbamoyl)phenyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[2-(3-methoxypropylcarbamoyl)phenyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[2-(3-methoxypropylcarbamoyl)phenyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-chloro-N-[2-[(3-methoxypropylamino)-oxomethyl]phenyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[2-(3-methoxypropylcarbamoyl)phenyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[2-(3-methoxypropylcarbamoyl)phenyl]benzamide Formula: C24H30ClN3O5S MolecularWeight: 508.0301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

Isomeric SMILES

COCCCNC(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C24H30ClN3O5S/c1-33-16-8-13-26-23(29)19-9-4-5-10-22(19)27-24(30)20-17-18(11-12-21(20)25)34(31,32)28-14-6-2-3-7-15-28/h4-5,9-12,17H,2-3,6-8,13-16H2,1H3,(H,26,29)(H,27,30)