2-[(Z)-1-chloranyl-2-(4-ethoxyphenyl)ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 2-[(Z)-1-chloranyl-2-(4-ethoxyphenyl)ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 2-[(Z)-1-chloro-2-(4-ethoxyphenyl)vinyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2-[(Z)-1-chloro-2-(4-ethoxyphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid IUPAC Name: 2-[(Z)-1-chloro-2-(4-ethoxyphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 2-[(Z)-1-chloro-2-p-phenetyl-vinyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C2=NC3=C(C(=C(S3)C(=O)O)C)C(=O)N2)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C(/C2=NC3=C(C(=C(S3)C(=O)O)C)C(=O)N2)\Cl

InChI

InChI=1S/C18H15ClN2O4S/c1-3-25-11-6-4-10(5-7-11)8-12(19)15-20-16(22)13-9(2)14(18(23)24)26-17(13)21-15/h4-8H,3H2,1-2H3,(H,23,24)(H,20,21,22)/b12-8-