N-[3-[butyl(methyl)amino]propyl]-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[butyl(methyl)amino]propyl]-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[butyl(methyl)amino]propyl]-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O/c1-4-5-13-26(3)14-9-12-24-22(29)21-18-25-28(20-11-8-10-19(2)17-20)23(21)27-15-6-7-16-27/h6-8,10-11,15-18H,4-5,9,12-14H2,1-3H3,(H,24,29)