2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-3-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-3-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6-iodo-3-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one Formula: C23H16BrIN2O3S MolecularWeight: 607.25821

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H16BrIN2O3S/c1-30-18-9-7-17(8-10-18)27-22(29)19-12-16(25)6-11-20(19)26-23(27)31-13-21(28)14-2-4-15(24)5-3-14/h2-12H,13H2,1H3