N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]-3-methyl-1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[4-(2-fluorophenyl)piperazino]propyl]-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C29H33FN6O MolecularWeight: 500.610323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4F)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4F)N5C=CC=C5

InChI

InChI=1S/C29H33FN6O/c1-22-10-12-24(13-11-22)36-29(35-16-5-6-17-35)27(23(2)32-36)28(37)31-14-7-15-33-18-20-34(21-19-33)26-9-4-3-8-25(26)30/h3-6,8-13,16-17H,7,14-15,18-21H2,1-2H3,(H,31,37)