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

Systemtic Name: N-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethyl]-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]ethyl]-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethyl]-1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl]-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[2-[4-(5-chloro-2-methyl-phenyl)piperazino]ethyl]-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)NCCN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)N5C=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C28H31ClN6O/c1-21-5-9-24(10-6-21)35-28(34-12-3-4-13-34)25(20-31-35)27(36)30-11-14-32-15-17-33(18-16-32)26-19-23(29)8-7-22(26)2/h3-10,12-13,19-20H,11,14-18H2,1-2H3,(H,30,36)