2-[3-oxidanylidene-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propyl]-1H-quinazolin-4-one

Systemtic Name: 2-[3-oxidanylidene-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propyl]-1H-quinazolin-4-one Openeye Name: 2-[3-oxo-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propyl]-1H-quinazolin-4-one CAS Name: 2-[3-oxo-3-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]propyl]-1H-quinazolin-4-one IUPAC Name: 2-[3-oxo-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propyl]-1H-quinazolin-4-one Traditional Name: 2-[3-keto-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]propyl]-1H-quinazolin-4-one Formula: C22H21F3N4O4S MolecularWeight: 494.48675

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H21F3N4O4S/c23-22(24,25)15-4-3-5-16(14-15)34(32,33)29-12-10-28(11-13-29)20(30)9-8-19-26-18-7-2-1-6-17(18)21(31)27-19/h1-7,14H,8-13H2,(H,26,27,31)