butan-2-yl 2-(6-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: butan-2-yl 2-(6-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: sec-butyl 2-(6-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 2-(6-methyl-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)propanoic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-(6-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 2-(4-keto-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid sec-butyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C(C)N1C=NC2=C(C1=O)C(=C(S2)C)C3=CC=CC=C3

Isomeric SMILES

CCC(C)OC(=O)C(C)N1C=NC2=C(C1=O)C(=C(S2)C)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S/c1-5-12(2)25-20(24)13(3)22-11-21-18-17(19(22)23)16(14(4)26-18)15-9-7-6-8-10-15/h6-13H,5H2,1-4H3