2-[(3,4-dimethoxyphenyl)-methylsulfonyl-amino]-N-[2-methyl-4-(2-phenylsulfanylethyl)phenyl]ethanamide

Systemtic Name: 2-[(3,4-dimethoxyphenyl)-methylsulfonyl-amino]-N-[2-methyl-4-(2-phenylsulfanylethyl)phenyl]ethanamide Openeye Name: 2-(3,4-dimethoxy-N-methylsulfonyl-anilino)-N-[2-methyl-4-(2-phenylsulfanylethyl)phenyl]acetamide CAS Name: 2-(3,4-dimethoxy-N-methylsulfonylanilino)-N-[2-methyl-4-[2-(phenylthio)ethyl]phenyl]acetamide IUPAC Name: 2-(3,4-dimethoxy-N-methylsulfonylanilino)-N-[2-methyl-4-(2-phenylsulfanylethyl)phenyl]acetamide Traditional Name: 2-(N-mesyl-3,4-dimethoxy-anilino)-N-[2-methyl-4-[2-(phenylthio)ethyl]phenyl]acetamide Formula: C26H30N2O5S2 MolecularWeight: 514.6568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCSC2=CC=CC=C2)NC(=O)CN(C3=CC(=C(C=C3)OC)OC)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)CCSC2=CC=CC=C2)NC(=O)CN(C3=CC(=C(C=C3)OC)OC)S(=O)(=O)C

InChI

InChI=1S/C26H30N2O5S2/c1-19-16-20(14-15-34-22-8-6-5-7-9-22)10-12-23(19)27-26(29)18-28(35(4,30)31)21-11-13-24(32-2)25(17-21)33-3/h5-13,16-17H,14-15,18H2,1-4H3,(H,27,29)