N-(2-chloranyl-4,6-dimethyl-phenyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-4-keto-4-(3-phenyl-2-pyrazolin-1-yl)butyramide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22ClN3O2/c1-14-12-15(2)21(17(22)13-14)23-19(26)8-9-20(27)25-11-10-18(24-25)16-6-4-3-5-7-16/h3-7,12-13H,8-11H2,1-2H3,(H,23,26)