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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1N=C(N(C2=O)CCC(=O)N)SCC(=O)O

Isomeric SMILES

C1=CSC2=C1N=C(N(C2=O)CCC(=O)N)SCC(=O)O

InChI

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