N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[4-(3-chlorophenyl)piperazino]propyl]-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C28H31ClN6O MolecularWeight: 503.03834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCCN3CCN(CC3)C4=CC(=CC=C4)Cl)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCCN3CCN(CC3)C4=CC(=CC=C4)Cl)N5C=CC=C5

InChI

InChI=1S/C28H31ClN6O/c1-22-8-10-24(11-9-22)35-28(34-14-2-3-15-34)26(21-31-35)27(36)30-12-5-13-32-16-18-33(19-17-32)25-7-4-6-23(29)20-25/h2-4,6-11,14-15,20-21H,5,12-13,16-19H2,1H3,(H,30,36)