4-[(4-methylphenyl)-methylsulfonyl-amino]-N-(3-methylsulfanylphenyl)butanamide

Systemtic Name: 4-[(4-methylphenyl)-methylsulfonyl-amino]-N-(3-methylsulfanylphenyl)butanamide Openeye Name: 4-(4-methyl-N-methylsulfonyl-anilino)-N-(3-methylsulfanylphenyl)butanamide CAS Name: 4-(4-methyl-N-methylsulfonylanilino)-N-[3-(methylthio)phenyl]butanamide IUPAC Name: 4-(4-methyl-N-methylsulfonylanilino)-N-(3-methylsulfanylphenyl)butanamide Traditional Name: 4-(N-mesyl-4-methyl-anilino)-N-[3-(methylthio)phenyl]butyramide Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCCC(=O)NC2=CC(=CC=C2)SC)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCCC(=O)NC2=CC(=CC=C2)SC)S(=O)(=O)C

InChI

InChI=1S/C19H24N2O3S2/c1-15-9-11-17(12-10-15)21(26(3,23)24)13-5-8-19(22)20-16-6-4-7-18(14-16)25-2/h4,6-7,9-12,14H,5,8,13H2,1-3H3,(H,20,22)