ethyl 5-[2,4-bis(oxidanylidene)-5,7-dihydro-1H-thieno[3,4-d]pyrimidin-3-yl]-2-chloranyl-benzoate

Systemtic Name: ethyl 5-[2,4-bis(oxidanylidene)-5,7-dihydro-1H-thieno[3,4-d]pyrimidin-3-yl]-2-chloranyl-benzoate Openeye Name: ethyl 2-chloro-5-(2,4-dioxo-5,7-dihydro-1H-thieno[3,4-d]pyrimidin-3-yl)benzoate CAS Name: 2-chloro-5-(2,4-dioxo-5,7-dihydro-1H-thieno[3,4-d]pyrimidin-3-yl)benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-(2,4-dioxo-5,7-dihydro-1H-thieno[3,4-d]pyrimidin-3-yl)benzoate Traditional Name: 2-chloro-5-(2,4-diketo-5,7-dihydro-1H-thieno[3,4-d]pyrimidin-3-yl)benzoic acid ethyl ester Formula: C15H13ClN2O4S MolecularWeight: 352.79272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C3=C(CSC3)NC2=O)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C3=C(CSC3)NC2=O)Cl

InChI

InChI=1S/C15H13ClN2O4S/c1-2-22-14(20)9-5-8(3-4-11(9)16)18-13(19)10-6-23-7-12(10)17-15(18)21/h3-5H,2,6-7H2,1H3,(H,17,21)