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

Systemtic Name: ethyl 2-[2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-bromo-4-oxo-quinazolin-3-yl)acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(6-bromo-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-bromo-4-oxoquinazolin-3-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-(6-bromo-4-keto-quinazolin-3-yl)acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H18BrN3O4S MolecularWeight: 464.33292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br)C(=O)OCC

InChI

InChI=1S/C19H18BrN3O4S/c1-3-12-8-14(19(26)27-4-2)17(28-12)22-16(24)9-23-10-21-15-6-5-11(20)7-13(15)18(23)25/h5-8,10H,3-4,9H2,1-2H3,(H,22,24)