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

Systemtic Name: 1-(3-methylphenyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(3-methylphenyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-1-(3-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C26H29N5O MolecularWeight: 427.54136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCCCN(C)CC3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCCCN(C)CC3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C26H29N5O/c1-21-10-8-13-23(18-21)31-26(30-16-6-7-17-30)24(19-28-31)25(32)27-14-9-15-29(2)20-22-11-4-3-5-12-22/h3-8,10-13,16-19H,9,14-15,20H2,1-2H3,(H,27,32)