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

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

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

Isomeric SMILES

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

InChI

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