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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-(methylthio)-2-(tosylamino)butyramide Formula: C18H20ClFN2O3S2 MolecularWeight: 430.944403

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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)F)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClFN2O3S2/c1-12-3-6-14(7-4-12)27(24,25)22-17(9-10-26-2)18(23)21-13-5-8-16(20)15(19)11-13/h3-8,11,17,22H,9-10H2,1-2H3,(H,21,23)