2-methylpropyl 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate

Systemtic Name: 2-methylpropyl 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: isobutyl 2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: 2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)butanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: 2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butyric acid isobutyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(C)C)N1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)OCC(C)C)N1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S/c1-4-16(20(24)25-10-13(2)3)22-12-21-18-17(19(22)23)15(11-26-18)14-8-6-5-7-9-14/h5-9,11-13,16H,4,10H2,1-3H3