4-[3-[3-(3-methylbutylsulfonyl)phenoxy]phenyl]-8-(trifluoromethyl)quinazoline

Systemtic Name: 4-[3-[3-(3-methylbutylsulfonyl)phenoxy]phenyl]-8-(trifluoromethyl)quinazoline Openeye Name: 4-[3-(3-isopentylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinazoline CAS Name: 4-[3-[3-(3-methylbutylsulfonyl)phenoxy]phenyl]-8-(trifluoromethyl)quinazoline IUPAC Name: 4-[3-[3-(3-methylbutylsulfonyl)phenoxy]phenyl]-8-(trifluoromethyl)quinazoline Traditional Name: 4-[3-(3-isoamylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinazoline Formula: C26H23F3N2O3S MolecularWeight: 500.53263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCS(=O)(=O)C1=CC=CC(=C1)OC2=CC=CC(=C2)C3=NC=NC4=C3C=CC=C4C(F)(F)F

Isomeric SMILES

CC(C)CCS(=O)(=O)C1=CC=CC(=C1)OC2=CC=CC(=C2)C3=NC=NC4=C3C=CC=C4C(F)(F)F

InChI

InChI=1S/C26H23F3N2O3S/c1-17(2)12-13-35(32,33)21-9-4-8-20(15-21)34-19-7-3-6-18(14-19)24-22-10-5-11-23(26(27,28)29)25(22)31-16-30-24/h3-11,14-17H,12-13H2,1-2H3