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

Systemtic Name: 2-[(Z)-2-[3,4-bis(fluoranyl)phenyl]-1-chloranyl-ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-(3,4-difluorophenyl)vinyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(3,4-difluorophenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-(3,4-difluorophenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(3,4-difluorophenyl)vinyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C16H8ClF2N2O3S- MolecularWeight: 381.761126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(=CC3=CC(=C(C=C3)F)F)Cl)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)/C(=C/C3=CC(=C(C=C3)F)F)/Cl)C(=O)[O-]

InChI

InChI=1S/C16H9ClF2N2O3S/c1-6-11-14(22)20-13(21-15(11)25-12(6)16(23)24)8(17)4-7-2-3-9(18)10(19)5-7/h2-5H,1H3,(H,23,24)(H,20,21,22)/p-1/b8-4-