N-(5-aminocarbonyl-2-methoxy-phenyl)-3-[(3-bromophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(5-aminocarbonyl-2-methoxy-phenyl)-3-[(3-bromophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-[(3-bromophenyl)methyl]-N-(5-carbamoyl-2-methoxy-phenyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-[(3-bromophenyl)methyl]-N-(5-carbamoyl-2-methoxyphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-[(3-bromophenyl)methyl]-N-(5-carbamoyl-2-methoxyphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(3-bromobenzyl)-N-(5-carbamoyl-2-methoxy-phenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H19BrN4O4S MolecularWeight: 539.40106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4=CC(=CC=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H19BrN4O4S/c1-33-20-8-6-14(21(26)30)10-19(20)27-22(31)15-5-7-17-18(11-15)28-24(34)29(23(17)32)12-13-3-2-4-16(25)9-13/h2-11H,12H2,1H3,(H2,26,30)(H,27,31)(H,28,34)