ethyl 3-[[5-(4-methylphenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]propanoate

Systemtic Name: ethyl 3-[[5-(4-methylphenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]propanoate Openeye Name: ethyl 3-[[4-oxo-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]propanoate CAS Name: 3-[[5-(4-methylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[5-(4-methylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]propanoate Traditional Name: 3-[[4-keto-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]thio]propionic acid ethyl ester Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)N1

Isomeric SMILES

CCOC(=O)CCSC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)N1

InChI

InChI=1S/C18H18N2O3S2/c1-3-23-14(21)8-9-24-18-19-16(22)15-13(10-25-17(15)20-18)12-6-4-11(2)5-7-12/h4-7,10H,3,8-9H2,1-2H3,(H,19,20,22)