4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[(2-ethoxyphenyl)methyl]butanamide

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[(2-ethoxyphenyl)methyl]butanamide Openeye Name: 4-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[(2-ethoxyphenyl)methyl]butanamide CAS Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[(2-ethoxyphenyl)methyl]butanamide IUPAC Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[(2-ethoxyphenyl)methyl]butanamide Traditional Name: 4-(5-chloro-N-mesyl-2-methyl-anilino)-N-(2-ethoxybenzyl)butyramide Formula: C21H27ClN2O4S MolecularWeight: 438.96808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC(=O)CCCN(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)CCCN(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O4S/c1-4-28-20-9-6-5-8-17(20)15-23-21(25)10-7-13-24(29(3,26)27)19-14-18(22)12-11-16(19)2/h5-6,8-9,11-12,14H,4,7,10,13,15H2,1-3H3,(H,23,25)