5-chloranyl-N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Formula: C21H18ClFN4O2 MolecularWeight: 412.844623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H18ClFN4O2/c1-12-18(19(22)27(26-12)17-9-5-14(23)6-10-17)21(29)25-16-4-2-3-13(11-16)20(28)24-15-7-8-15/h2-6,9-11,15H,7-8H2,1H3,(H,24,28)(H,25,29)