tert-butyl 2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: tert-butyl 2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoate Openeye Name: tert-butyl 2-(4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetic acid tert-butyl ester Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NC2=C(C=CS2)C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NC2=C(C=CS2)C(=O)N1C3=CC=CC=C3

InChI

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