methyl 2-[1-(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethylsulfanyl]ethanoate

Systemtic Name: methyl 2-[1-(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethylsulfanyl]ethanoate Openeye Name: methyl 2-[1-(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethylsulfanyl]acetate CAS Name: 2-[1-(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethylthio]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethylsulfanyl]acetate Traditional Name: 2-[1-(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethylthio]acetic acid methyl ester Formula: C17H16N2O3S2 MolecularWeight: 360.45054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)SCC(=O)OC

Isomeric SMILES

CC(C1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)SCC(=O)OC

InChI

InChI=1S/C17H16N2O3S2/c1-10(23-9-13(20)22-2)15-18-16(21)14-12(8-24-17(14)19-15)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,18,19,21)