3-[2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoyl-methyl-amino]propanoate

Systemtic Name: 3-[2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoyl-methyl-amino]propanoate Openeye Name: 3-[[2-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetyl]-methyl-amino]propanoate CAS Name: 3-[[2-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-oxoethyl]-methylamino]propanoate IUPAC Name: 3-[[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]-methylamino]propanoate Traditional Name: 3-[[2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]-methyl-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)CC(=O)N(C)CCC(=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4S/c1-8-9(2)22-13-12(8)14(21)17(7-15-13)6-10(18)16(3)5-4-11(19)20/h7H,4-6H2,1-3H3,(H,19,20)/p-1