N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NC3=NN(C=C3Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NC3=NN(C=C3Cl)CC4=CC=CC=C4

InChI

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