N-(2-chloranyl-5-methylsulfonyl-phenyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-4-keto-4-(3-phenyl-2-pyrazolin-1-yl)butyramide Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H20ClN3O4S/c1-29(27,28)15-7-8-16(21)18(13-15)22-19(25)9-10-20(26)24-12-11-17(23-24)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H,22,25)