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

Systemtic Name: 2-[(Z)-1-chloranyl-2-(4-propan-2-ylphenyl)ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-(4-isopropylphenyl)vinyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(4-propan-2-ylphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-(4-propan-2-ylphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-p-cumenyl-vinyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C19H16ClN2O3S- MolecularWeight: 387.85994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN2O3S/c1-9(2)12-6-4-11(5-7-12)8-13(20)16-21-17(23)14-10(3)15(19(24)25)26-18(14)22-16/h4-9H,1-3H3,(H,24,25)(H,21,22,23)/p-1/b13-8-