1-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(p-tolyl)-N-(2-pyridylmethyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(4-methylphenyl)-N-(2-pyridinylmethyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(p-tolyl)-N-(2-pyridylmethyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CC=N3)N4C=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CC=N3)N4C=CC=C4

InChI

InChI=1S/C21H19N5O/c1-16-7-9-18(10-8-16)26-21(25-12-4-5-13-25)19(15-24-26)20(27)23-14-17-6-2-3-11-22-17/h2-13,15H,14H2,1H3,(H,23,27)