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

Systemtic Name: butyl 2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoate Openeye Name: 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 butyl ester IUPAC Name: 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 butyl ester Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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