N-butyl-2-[(4-methoxy-3-methyl-phenyl)sulfonyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-butyl-2-[(4-methoxy-3-methyl-phenyl)sulfonyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-(4-methoxy-3-methyl-phenyl)sulfonyl-amino]-N-butyl-acetamide CAS Name: N-butyl-2-[(4-methoxy-3-methylphenyl)sulfonyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-(4-methoxy-3-methylphenyl)sulfonylamino]-N-butylacetamide Traditional Name: 2-[benzyl-(4-methoxy-3-methyl-phenyl)sulfonyl-amino]-N-butyl-acetamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)C

Isomeric SMILES

CCCCNC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)C

InChI

InChI=1S/C21H28N2O4S/c1-4-5-13-22-21(24)16-23(15-18-9-7-6-8-10-18)28(25,26)19-11-12-20(27-3)17(2)14-19/h6-12,14H,4-5,13,15-16H2,1-3H3,(H,22,24)