ethyl 2-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(2-chloro-6,7-dimethoxy-4-quinazolinyl)amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H17ClN4O4S MolecularWeight: 408.85928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=NC(=NC3=CC(=C(C=C32)OC)OC)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=NC(=NC3=CC(=C(C=C32)OC)OC)Cl)C

InChI

InChI=1S/C17H17ClN4O4S/c1-5-26-15(23)13-8(2)19-17(27-13)22-14-9-6-11(24-3)12(25-4)7-10(9)20-16(18)21-14/h6-7H,5H2,1-4H3,(H,19,20,21,22)