2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)acetamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-methyl-amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C21H22ClFN4O2 MolecularWeight: 416.876383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CN(C)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CN(C)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H22ClFN4O2/c1-14-20(21(29)27(26(14)3)15-8-5-4-6-9-15)24-19(28)13-25(2)12-16-17(22)10-7-11-18(16)23/h4-11H,12-13H2,1-3H3,(H,24,28)