N-(2-chloranyl-4-methyl-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(2-chloro-4-methylphenyl)-1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(2-chloro-4-methylphenyl)-1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H16ClFN4O MolecularWeight: 394.829343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4)Cl

InChI

InChI=1S/C21H16ClFN4O/c1-14-4-9-19(18(22)12-14)25-20(28)17-13-24-27(16-7-5-15(23)6-8-16)21(17)26-10-2-3-11-26/h2-13H,1H3,(H,25,28)