2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]ethanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[3-(o-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[3-[(2-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(N-mesyl-3,4-dimethyl-anilino)-N-[3-[(2-methylbenzyl)thio]propyl]acetamide Formula: C22H30N2O3S2 MolecularWeight: 434.6152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NCCCSCC2=CC=CC=C2C)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NCCCSCC2=CC=CC=C2C)S(=O)(=O)C)C

InChI

InChI=1S/C22H30N2O3S2/c1-17-10-11-21(14-19(17)3)24(29(4,26)27)15-22(25)23-12-7-13-28-16-20-9-6-5-8-18(20)2/h5-6,8-11,14H,7,12-13,15-16H2,1-4H3,(H,23,25)