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

Systemtic Name: 2-[(Z)-1-chloranyl-2-quinolin-6-yl-ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-(6-quinolyl)vinyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(6-quinolinyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-quinolin-6-ylethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(6-quinolyl)vinyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C19H11ClN3O3S- MolecularWeight: 396.82694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(=CC3=CC4=C(C=C3)N=CC=C4)Cl)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)/C(=C/C3=CC4=C(C=C3)N=CC=C4)/Cl)C(=O)[O-]

InChI

InChI=1S/C19H12ClN3O3S/c1-9-14-17(24)22-16(23-18(14)27-15(9)19(25)26)12(20)8-10-4-5-13-11(7-10)3-2-6-21-13/h2-8H,1H3,(H,25,26)(H,22,23,24)/p-1/b12-8-