1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N-methylsulfonyl-5-oxidanylidene-N-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-3-carboxamide

Systemtic Name: 1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N-methylsulfonyl-5-oxidanylidene-N-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-3-carboxamide Openeye Name: 1-[(3-chloro-4-fluoro-phenyl)methyl]-N-methylsulfonyl-5-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-3-carboxamide CAS Name: 1-[(3-chloro-4-fluorophenyl)methyl]-N-methylsulfonyl-5-oxo-N-(1,3,5-trimethyl-4-pyrazolyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-[(3-chloro-4-fluorophenyl)methyl]-N-methylsulfonyl-5-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-3-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-benzyl)-5-keto-N-mesyl-N-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-3-carboxamide Formula: C19H22ClFN4O4S MolecularWeight: 456.918783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)N(C(=O)C2CC(=O)N(C2)CC3=CC(=C(C=C3)F)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1C)C)N(C(=O)C2CC(=O)N(C2)CC3=CC(=C(C=C3)F)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H22ClFN4O4S/c1-11-18(12(2)23(3)22-11)25(30(4,28)29)19(27)14-8-17(26)24(10-14)9-13-5-6-16(21)15(20)7-13/h5-7,14H,8-10H2,1-4H3