2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]quinazolin-4-one Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]quinazolin-4-one CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-quinazolinone IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]quinazolin-4-one Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-6,7-dimethoxy-3-p-anisyl-quinazolin-4-one Formula: C26H23BrN2O5S MolecularWeight: 555.44022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC(=C(C=C3N=C2SCC(=O)C4=CC=C(C=C4)Br)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC(=C(C=C3N=C2SCC(=O)C4=CC=C(C=C4)Br)OC)OC

InChI

InChI=1S/C26H23BrN2O5S/c1-32-19-10-4-16(5-11-19)14-29-25(31)20-12-23(33-2)24(34-3)13-21(20)28-26(29)35-15-22(30)17-6-8-18(27)9-7-17/h4-13H,14-15H2,1-3H3