2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-[(4S)-2,2-dimethyloxan-4-yl]quinazolin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-[(4S)-2,2-dimethyloxan-4-yl]quinazolin-4-one Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]quinazolin-4-one CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-3-[(4S)-2,2-dimethyl-4-oxanyl]-4-quinazolinone IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-[(4S)-2,2-dimethyloxan-4-yl]quinazolin-4-one Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]quinazolin-4-one Formula: C23H23BrN2O3S MolecularWeight: 487.40932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1(C[C@H](CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H23BrN2O3S/c1-23(2)13-17(11-12-29-23)26-21(28)18-5-3-4-6-19(18)25-22(26)30-14-20(27)15-7-9-16(24)10-8-15/h3-10,17H,11-14H2,1-2H3/t17-/m0/s1