3-methyl-2-[1-[3-methyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-methyl-2-[1-[3-methyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-methyl-2-[1-[3-methyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-methyl-2-[1-[3-methyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-methyl-2-[1-[3-methyl-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 3-methyl-2-[1-[3-methyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazino]ethyl]quinazolin-4-one Formula: C23H25F3N4O3S MolecularWeight: 494.52981

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C(C)C3=NC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C(C)C3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C23H25F3N4O3S/c1-15-14-29(16(2)21-27-20-10-5-4-9-19(20)22(31)28(21)3)11-12-30(15)34(32,33)18-8-6-7-17(13-18)23(24,25)26/h4-10,13,15-16H,11-12,14H2,1-3H3