2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-(2-methylpropyl)ethanamide Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-isobutyl-acetamide CAS Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-phenethylamino]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-phenethylamino]-N-(2-methylpropyl)acetamide Traditional Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-isobutyl-acetamide Formula: C21H27ClN2O4S MolecularWeight: 438.96808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)CNC(=O)CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C21H27ClN2O4S/c1-16(2)14-23-21(25)15-24(12-11-17-7-5-4-6-8-17)29(26,27)18-9-10-20(28-3)19(22)13-18/h4-10,13,16H,11-12,14-15H2,1-3H3,(H,23,25)