4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[(3-ethoxyphenyl)methyl]butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[(3-ethoxyphenyl)methyl]butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-[(3-ethoxyphenyl)methyl]butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[(3-ethoxyphenyl)methyl]butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[(3-ethoxyphenyl)methyl]butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(3-ethoxybenzyl)butyramide Formula: C21H27ClN2O5S MolecularWeight: 454.96748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CNC(=O)CCCN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)CNC(=O)CCCN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O5S/c1-4-29-18-8-5-7-16(13-18)15-23-21(25)9-6-12-24(30(3,26)27)17-10-11-20(28-2)19(22)14-17/h5,7-8,10-11,13-14H,4,6,9,12,15H2,1-3H3,(H,23,25)