ethyl 2-[1-chloranyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylidene]-5-methyl-4-oxidanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-[1-chloranyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylidene]-5-methyl-4-oxidanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[1-chloro-2-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-5-methyl-4-oxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[1-chloro-2-(4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-5-methyl-4-oxo-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-chloro-2-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-5-methyl-4-oxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[1-chloro-2-(4-ketocyclohexa-2,5-dien-1-ylidene)ethylidene]-4-keto-5-methyl-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)NC(=C(C=C3C=CC(=O)C=C3)Cl)NC2=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)NC(=C(C=C3C=CC(=O)C=C3)Cl)NC2=O)C

InChI

InChI=1S/C18H15ClN2O4S/c1-3-25-18(24)14-9(2)13-16(23)20-15(21-17(13)26-14)12(19)8-10-4-6-11(22)7-5-10/h4-8,21H,3H2,1-2H3,(H,20,23)