N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(p-tolyl)-1H-pyrazole-5-carboxamide CAS Name: N-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(p-tolyl)-1H-pyrazole-5-carboxamide Formula: C21H18ClN5O MolecularWeight: 391.85352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Cl

InChI

InChI=1S/C21H18ClN5O/c1-14-5-7-16(8-6-14)19-10-20(26-25-19)21(28)24-18-4-2-3-15(9-18)12-27-13-17(22)11-23-27/h2-11,13H,12H2,1H3,(H,24,28)(H,25,26)