N-[2-(4-methylpiperazin-1-yl)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-(4-methyl-1-piperazinyl)ethyl]-1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-(4-methylpiperazino)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C27H35N7O2 MolecularWeight: 489.6125

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CN1CCN(CC1)CCNC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C27H35N7O2/c1-30-17-19-31(20-18-30)16-11-28-25(35)22-9-14-33(15-10-22)27(36)24-21-29-34(23-7-3-2-4-8-23)26(24)32-12-5-6-13-32/h2-8,12-13,21-22H,9-11,14-20H2,1H3,(H,28,35)