4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide Openeye Name: 4-[3-(6-bromo-4-oxo-quinazolin-3-yl)propanoylamino]-N-thiazol-2-yl-benzamide CAS Name: 4-[[3-(6-bromo-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]-N-(2-thiazolyl)benzamide IUPAC Name: 4-[3-(6-bromo-4-oxoquinazolin-3-yl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide Traditional Name: 4-[3-(6-bromo-4-keto-quinazolin-3-yl)propanoylamino]-N-thiazol-2-yl-benzamide Formula: C21H16BrN5O3S MolecularWeight: 498.35244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NC=CS2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NC=CS2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H16BrN5O3S/c22-14-3-6-17-16(11-14)20(30)27(12-24-17)9-7-18(28)25-15-4-1-13(2-5-15)19(29)26-21-23-8-10-31-21/h1-6,8,10-12H,7,9H2,(H,25,28)(H,23,26,29)