N-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethyl]-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethyl]-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]ethyl]-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethyl]-3-methyl-1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl]-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[2-[4-(5-chloro-2-methyl-phenyl)piperazino]ethyl]-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C29H33ClN6O MolecularWeight: 517.06492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C(=O)NCCN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C(=O)NCCN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)N5C=CC=C5

InChI

InChI=1S/C29H33ClN6O/c1-21-6-10-25(11-7-21)36-29(35-13-4-5-14-35)27(23(3)32-36)28(37)31-12-15-33-16-18-34(19-17-33)26-20-24(30)9-8-22(26)2/h4-11,13-14,20H,12,15-19H2,1-3H3,(H,31,37)