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

Systemtic Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]-3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[4-(2-fluorophenyl)piperazino]propyl]-3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C28H31FN6O MolecularWeight: 486.583743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3F)N4C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3F)N4C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H31FN6O/c1-22-26(28(34-16-7-8-17-34)35(31-22)23-10-3-2-4-11-23)27(36)30-14-9-15-32-18-20-33(21-19-32)25-13-6-5-12-24(25)29/h2-8,10-13,16-17H,9,14-15,18-21H2,1H3,(H,30,36)