3-[(6-aminocarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate

Systemtic Name: 3-[(6-aminocarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate Openeye Name: 3-[(6-carbamoyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate CAS Name: 3-[(6-carbamoyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)thio]propanoate IUPAC Name: 3-[(6-carbamoyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate Traditional Name: 3-[(6-carbamoyl-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]propionate Formula: C11H10N3O4S2- MolecularWeight: 312.3448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)SCCC(=O)[O-])C(=O)N

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)SCCC(=O)[O-])C(=O)N

InChI

InChI=1S/C11H11N3O4S2/c1-4-6-9(18)13-11(19-3-2-5(15)16)14-10(6)20-7(4)8(12)17/h2-3H2,1H3,(H2,12,17)(H,15,16)(H,13,14,18)/p-1