3-(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(5-bromo-2-methoxy-3-methyl-benzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]-6-iodo-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(5-bromo-2-methoxy-3-methylbenzoyl)-6-iodo-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(5-bromo-2-methoxy-3-methyl-benzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one Formula: C17H12BrIN2O3S MolecularWeight: 531.16225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)N2C(=O)C3=C(C=CC(=C3)I)NC2=S)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)N2C(=O)C3=C(C=CC(=C3)I)NC2=S)OC

InChI

InChI=1S/C17H12BrIN2O3S/c1-8-5-9(18)6-12(14(8)24-2)16(23)21-15(22)11-7-10(19)3-4-13(11)20-17(21)25/h3-7H,1-2H3,(H,20,25)