6-bromanyl-2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)carbonyl-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)carbonyl-1H-quinazolin-4-one Openeye Name: 6-bromo-2-thioxo-3-(3,4,5-trimethoxybenzoyl)-1H-quinazolin-4-one CAS Name: 6-bromo-3-[oxo-(3,4,5-trimethoxyphenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-2-sulfanylidene-3-(3,4,5-trimethoxybenzoyl)-1H-quinazolin-4-one Traditional Name: 6-bromo-2-thioxo-3-(3,4,5-trimethoxybenzoyl)-1H-quinazolin-4-one Formula: C18H15BrN2O5S MolecularWeight: 451.2911

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S

InChI

InChI=1S/C18H15BrN2O5S/c1-24-13-6-9(7-14(25-2)15(13)26-3)16(22)21-17(23)11-8-10(19)4-5-12(11)20-18(21)27/h4-8H,1-3H3,(H,20,27)