[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O4S/c1-10(13(21)18-16(2,3)4)23-12(20)5-7-19-9-17-14-11(15(19)22)6-8-24-14/h6,8-10H,5,7H2,1-4H3,(H,18,21)