N-(4-acetamido-3-chloranyl-phenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(4-acetamido-3-chlorophenyl)-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-4-(methylthio)-2-(tosylamino)butyramide Formula: C20H24ClN3O4S2 MolecularWeight: 470.00526

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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)NC(=O)C)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3O4S2/c1-13-4-7-16(8-5-13)30(27,28)24-19(10-11-29-3)20(26)23-15-6-9-18(17(21)12-15)22-14(2)25/h4-9,12,19,24H,10-11H2,1-3H3,(H,22,25)(H,23,26)