2-[(5-chloranyl-2-methoxy-phenyl)-methylsulfonyl-amino]-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)-methylsulfonyl-amino]-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(5-chloro-2-methoxy-N-methylsulfonyl-anilino)-N-[2-(m-tolylmethylsulfanyl)ethyl]acetamide CAS Name: 2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-[2-[(3-methylphenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(5-chloro-N-mesyl-2-methoxy-anilino)-N-[2-[(3-methylbenzyl)thio]ethyl]acetamide Formula: C20H25ClN2O4S2 MolecularWeight: 457.0065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN2O4S2/c1-15-5-4-6-16(11-15)14-28-10-9-22-20(24)13-23(29(3,25)26)18-12-17(21)7-8-19(18)27-2/h4-8,11-12H,9-10,13-14H2,1-3H3,(H,22,24)