(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(4-methylquinolin-2-yl)sulfanylethanoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(4-methylquinolin-2-yl)sulfanylethanoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-[(4-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4-methyl-2-quinolinyl)thio]acetic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(4-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-quinolyl)thio]acetic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C19H15N3O3S2 MolecularWeight: 397.4707

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C19H15N3O3S2/c1-11-8-16(21-13-5-3-2-4-12(11)13)27-10-17(23)25-9-15-20-14-6-7-26-18(14)19(24)22-15/h2-8H,9-10H2,1H3,(H,20,22,24)