(4Z)-4-(4-phenyl-1,2-dihydropyrazol-3-ylidene)-N-(phenylmethyl)pyrrole-2-carboxamide

Systemtic Name: (4Z)-4-(4-phenyl-1,2-dihydropyrazol-3-ylidene)-N-(phenylmethyl)pyrrole-2-carboxamide Openeye Name: (4Z)-N-benzyl-4-(4-phenyl-1,2-dihydropyrazol-3-ylidene)pyrrole-2-carboxamide CAS Name: (4Z)-4-(4-phenyl-1,2-dihydropyrazol-3-ylidene)-N-(phenylmethyl)-2-pyrrolecarboxamide IUPAC Name: (4Z)-N-benzyl-4-(4-phenyl-1,2-dihydropyrazol-3-ylidene)pyrrole-2-carboxamide Traditional Name: (4Z)-N-benzyl-4-(4-phenyl-3-pyrazolin-3-ylidene)pyrrole-2-carboxamide Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC(=C3C(=CNN3)C4=CC=CC=C4)C=N2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C/C(=C/3\C(=CNN3)C4=CC=CC=C4)/C=N2

InChI

InChI=1S/C21H18N4O/c26-21(23-12-15-7-3-1-4-8-15)19-11-17(13-22-19)20-18(14-24-25-20)16-9-5-2-6-10-16/h1-11,13-14,24-25H,12H2,(H,23,26)/b20-17-