ethyl 2-[(Z)-1-chloranyl-2-(4-ethylphenyl)ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-[(Z)-1-chloranyl-2-(4-ethylphenyl)ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[(Z)-1-chloro-2-(4-ethylphenyl)vinyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(4-ethylphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(Z)-1-chloro-2-(4-ethylphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(4-ethylphenyl)vinyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C(C2=NC3=C(C(=C(S3)C(=O)OCC)C)C(=O)N2)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C(/C2=NC3=C(C(=C(S3)C(=O)OCC)C)C(=O)N2)\Cl

InChI

InChI=1S/C20H19ClN2O3S/c1-4-12-6-8-13(9-7-12)10-14(21)17-22-18(24)15-11(3)16(20(25)26-5-2)27-19(15)23-17/h6-10H,4-5H2,1-3H3,(H,22,23,24)/b14-10-