methyl 2-methyl-2-[3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoylamino]propanoate

Systemtic Name: methyl 2-methyl-2-[3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoylamino]propanoate Openeye Name: methyl 2-methyl-2-[3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoylamino]propanoate CAS Name: 2-methyl-2-[[1-oxo-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoylamino]propanoate Traditional Name: 2-[3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propanoylamino]-2-methyl-propionic acid methyl ester Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)CCN1C=NC2=C(C1=O)C=CS2

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)CCN1C=NC2=C(C1=O)C=CS2

InChI

InChI=1S/C14H17N3O4S/c1-14(2,13(20)21-3)16-10(18)4-6-17-8-15-11-9(12(17)19)5-7-22-11/h5,7-8H,4,6H2,1-3H3,(H,16,18)