2-[(2-chlorophenyl)-methylsulfonyl-amino]-N-[3-(3,4-dimethoxyphenyl)propyl]ethanamide

Systemtic Name: 2-[(2-chlorophenyl)-methylsulfonyl-amino]-N-[3-(3,4-dimethoxyphenyl)propyl]ethanamide Openeye Name: 2-(2-chloro-N-methylsulfonyl-anilino)-N-[3-(3,4-dimethoxyphenyl)propyl]acetamide CAS Name: 2-(2-chloro-N-methylsulfonylanilino)-N-[3-(3,4-dimethoxyphenyl)propyl]acetamide IUPAC Name: 2-(2-chloro-N-methylsulfonylanilino)-N-[3-(3,4-dimethoxyphenyl)propyl]acetamide Traditional Name: 2-(2-chloro-N-mesyl-anilino)-N-[3-(3,4-dimethoxyphenyl)propyl]acetamide Formula: C20H25ClN2O5S MolecularWeight: 440.9409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCCNC(=O)CN(C2=CC=CC=C2Cl)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCCNC(=O)CN(C2=CC=CC=C2Cl)S(=O)(=O)C)OC

InChI

InChI=1S/C20H25ClN2O5S/c1-27-18-11-10-15(13-19(18)28-2)7-6-12-22-20(24)14-23(29(3,25)26)17-9-5-4-8-16(17)21/h4-5,8-11,13H,6-7,12,14H2,1-3H3,(H,22,24)