3-[2-(2,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]propanoate

Systemtic Name: 3-[2-(2,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]propanoate Openeye Name: 3-[[2-(2,5,6-trimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]propanoate CAS Name: 3-[[1-oxo-2-(2,5,6-trimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]propanoate IUPAC Name: 3-[[2-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]propanoate Traditional Name: 3-[[2-(4-keto-2,5,6-trimethyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]propionate Formula: C14H16N3O4S- MolecularWeight: 322.35954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)C)CC(=O)NCCC(=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)C)CC(=O)NCCC(=O)[O-])C

InChI

InChI=1S/C14H17N3O4S/c1-7-8(2)22-13-12(7)14(21)17(9(3)16-13)6-10(18)15-5-4-11(19)20/h4-6H2,1-3H3,(H,15,18)(H,19,20)/p-1