1-phenyl-N-[4-(pyridin-4-ylmethyl)phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-phenyl-N-[4-(pyridin-4-ylmethyl)phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-phenyl-N-[4-(4-pyridylmethyl)phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-phenyl-N-[4-(pyridin-4-ylmethyl)phenyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-phenyl-N-[4-(pyridin-4-ylmethyl)phenyl]-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-phenyl-N-[4-(4-pyridylmethyl)phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C26H21N5O MolecularWeight: 419.47784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4)N5C=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4)N5C=CC=C5

InChI

InChI=1S/C26H21N5O/c32-25(29-22-10-8-20(9-11-22)18-21-12-14-27-15-13-21)24-19-28-31(23-6-2-1-3-7-23)26(24)30-16-4-5-17-30/h1-17,19H,18H2,(H,29,32)