2-[3-(3-azanyl-3-oxidanylidene-propyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-(3-azanyl-3-oxidanylidene-propyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-[3-(3-amino-3-oxo-propyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[3-(3-amino-3-oxopropyl)-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetic acid IUPAC Name: 2-[3-(3-amino-3-oxopropyl)-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetic acid Traditional Name: 2-[[3-(3-amino-3-keto-propyl)-4-keto-thieno[2,3-d]pyrimidin-2-yl]thio]acetic acid Formula: C11H11N3O4S2 MolecularWeight: 313.35274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1C(=O)N(C(=N2)SCC(=O)O)CCC(=O)N

Isomeric SMILES

C1=CSC2=C1C(=O)N(C(=N2)SCC(=O)O)CCC(=O)N

InChI

InChI=1S/C11H11N3O4S2/c12-7(15)1-3-14-10(18)6-2-4-19-9(6)13-11(14)20-5-8(16)17/h2,4H,1,3,5H2,(H2,12,15)(H,16,17)