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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=C(N(N=C1)C2=CC=CC(=C2)C)N3C=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CCCNC(=O)C1=C(N(N=C1)C2=CC=CC(=C2)C)N3C=CC=C3)CC4=CC=CC=C4

InChI

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