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

Systemtic Name: 3-methyl-1-(4-methylphenyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 3-methyl-1-(4-methylphenyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C27H31N5O MolecularWeight: 441.56794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N5O/c1-21-12-14-24(15-13-21)32-27(31-18-7-8-19-31)25(22(2)29-32)26(33)28-16-9-17-30(3)20-23-10-5-4-6-11-23/h4-8,10-15,18-19H,9,16-17,20H2,1-3H3,(H,28,33)