N-(4-bromanyl-3-methyl-phenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(methylthio)-2-(tosylamino)butyramide Formula: C19H23BrN2O3S2 MolecularWeight: 471.43152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C19H23BrN2O3S2/c1-13-4-7-16(8-5-13)27(24,25)22-18(10-11-26-3)19(23)21-15-6-9-17(20)14(2)12-15/h4-9,12,18,22H,10-11H2,1-3H3,(H,21,23)