4-[2-chloranyl-5-[(3-methylsulfonylphenyl)methoxy]phenyl]-2-methyl-8-(trifluoromethyl)quinazoline

Systemtic Name: 4-[2-chloranyl-5-[(3-methylsulfonylphenyl)methoxy]phenyl]-2-methyl-8-(trifluoromethyl)quinazoline Openeye Name: 4-[2-chloro-5-[(3-methylsulfonylphenyl)methoxy]phenyl]-2-methyl-8-(trifluoromethyl)quinazoline CAS Name: 4-[2-chloro-5-[(3-methylsulfonylphenyl)methoxy]phenyl]-2-methyl-8-(trifluoromethyl)quinazoline IUPAC Name: 4-[2-chloro-5-[(3-methylsulfonylphenyl)methoxy]phenyl]-2-methyl-8-(trifluoromethyl)quinazoline Traditional Name: 4-[2-chloro-5-(3-mesylbenzyl)oxy-phenyl]-2-methyl-8-(trifluoromethyl)quinazoline Formula: C24H18ClF3N2O3S MolecularWeight: 506.92453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C(F)(F)F)C(=N1)C3=C(C=CC(=C3)OCC4=CC(=CC=C4)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=NC2=C(C=CC=C2C(F)(F)F)C(=N1)C3=C(C=CC(=C3)OCC4=CC(=CC=C4)S(=O)(=O)C)Cl

InChI

InChI=1S/C24H18ClF3N2O3S/c1-14-29-22(18-7-4-8-20(23(18)30-14)24(26,27)28)19-12-16(9-10-21(19)25)33-13-15-5-3-6-17(11-15)34(2,31)32/h3-12H,13H2,1-2H3