N-butyl-N,3-dimethyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-butyl-N,3-dimethyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-butyl-N,3-dimethyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-butyl-N,3-dimethyl-1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-butyl-N,3-dimethyl-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-butyl-N,3-dimethyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H26N4O MolecularWeight: 350.45734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C)N3C=CC=C3

Isomeric SMILES

CCCCN(C)C(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C)N3C=CC=C3

InChI

InChI=1S/C21H26N4O/c1-5-6-13-23(4)21(26)19-17(3)22-25(18-11-9-16(2)10-12-18)20(19)24-14-7-8-15-24/h7-12,14-15H,5-6,13H2,1-4H3