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

Systemtic Name: ethyl 5-[2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-(6-chloro-4-oxo-quinazolin-3-yl)acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-(6-chloro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(6-chloro-4-oxoquinazolin-3-yl)acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-(6-chloro-4-keto-quinazolin-3-yl)acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl)C

InChI

InChI=1S/C18H16ClN3O4S/c1-3-26-18(25)16-10(2)6-15(27-16)21-14(23)8-22-9-20-13-5-4-11(19)7-12(13)17(22)24/h4-7,9H,3,8H2,1-2H3,(H,21,23)