6-bromanyl-3-(3-chloranyl-4-ethoxy-phenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-(3-chloranyl-4-ethoxy-phenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-bromo-3-(3-chloro-4-ethoxy-benzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-bromo-3-[(3-chloro-4-ethoxyphenyl)-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-3-(3-chloro-4-ethoxybenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-bromo-3-(3-chloro-4-ethoxy-benzoyl)-2-thioxo-1H-quinazolin-4-one Formula: C17H12BrClN2O3S MolecularWeight: 439.71078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrClN2O3S/c1-2-24-14-6-3-9(7-12(14)19)15(22)21-16(23)11-8-10(18)4-5-13(11)20-17(21)25/h3-8H,2H2,1H3,(H,20,25)