4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]carbonylpiperazin-2-one

Systemtic Name: 4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]carbonylpiperazin-2-one Openeye Name: 4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]piperazin-2-one CAS Name: 4-[oxo-[5-(1-pyrrolyl)-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]methyl]-2-piperazinone IUPAC Name: 4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]piperazin-2-one Traditional Name: 4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]piperazin-2-one Formula: C19H16F3N5O2 MolecularWeight: 403.35785

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4

InChI

InChI=1S/C19H16F3N5O2/c20-19(21,22)13-4-3-5-14(10-13)27-17(25-7-1-2-8-25)15(11-24-27)18(29)26-9-6-23-16(28)12-26/h1-5,7-8,10-11H,6,9,12H2,(H,23,28)