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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

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