ethyl 2-[2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-bromo-4-oxo-quinazolin-3-yl)acetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(6-bromo-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-bromo-4-oxoquinazolin-3-yl)acetyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(6-bromo-4-keto-quinazolin-3-yl)acetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H20BrN3O4S MolecularWeight: 478.3595

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrN3O4S/c1-4-13-11(3)29-18(17(13)20(27)28-5-2)23-16(25)9-24-10-22-15-7-6-12(21)8-14(15)19(24)26/h6-8,10H,4-5,9H2,1-3H3,(H,23,25)