1-(3-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(3-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(3-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(3-fluorophenyl)-N-[2-(4-methyl-1-piperazinyl)ethyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(3-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(3-fluorophenyl)-N-[2-(4-methylpiperazino)ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H25FN6O MolecularWeight: 396.461203

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC(=O)C2=C(N(N=C2)C3=CC(=CC=C3)F)N4C=CC=C4

Isomeric SMILES

CN1CCN(CC1)CCNC(=O)C2=C(N(N=C2)C3=CC(=CC=C3)F)N4C=CC=C4

InChI

InChI=1S/C21H25FN6O/c1-25-11-13-26(14-12-25)10-7-23-20(29)19-16-24-28(18-6-4-5-17(22)15-18)21(19)27-8-2-3-9-27/h2-6,8-9,15-16H,7,10-14H2,1H3,(H,23,29)