2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Formula: C21H27ClN2O5S MolecularWeight: 454.96748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C)OCC

InChI

InChI=1S/C21H27ClN2O5S/c1-4-28-19-10-9-16(13-20(19)29-5-2)11-12-23-21(25)15-24(30(3,26)27)18-8-6-7-17(22)14-18/h6-10,13-14H,4-5,11-12,15H2,1-3H3,(H,23,25)