N-[(2-bromophenyl)methyl]-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(2-bromophenyl)methyl]-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-1-phenyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(2-bromobenzyl)-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H17BrN4O MolecularWeight: 421.28988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CC=C3Br)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CC=C3Br)N4C=CC=C4

InChI

InChI=1S/C21H17BrN4O/c22-19-11-5-4-8-16(19)14-23-20(27)18-15-24-26(17-9-2-1-3-10-17)21(18)25-12-6-7-13-25/h1-13,15H,14H2,(H,23,27)