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

Systemtic Name: 6-bromanyl-3-(3,5-diethoxyphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-bromo-3-(3,5-diethoxybenzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-bromo-3-[(3,5-diethoxyphenyl)-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-3-(3,5-diethoxybenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-bromo-3-(3,5-diethoxybenzoyl)-2-thioxo-1H-quinazolin-4-one Formula: C19H17BrN2O4S MolecularWeight: 449.31828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S)OCC

InChI

InChI=1S/C19H17BrN2O4S/c1-3-25-13-7-11(8-14(10-13)26-4-2)17(23)22-18(24)15-9-12(20)5-6-16(15)21-19(22)27/h5-10H,3-4H2,1-2H3,(H,21,27)