2-azanyl-3-[(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylthio]propionic acid Formula: C12H16N4O2S2 MolecularWeight: 312.41104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)CSCC(C(=O)O)N)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)CSCC(C(=O)O)N)C

InChI

InChI=1S/C12H16N4O2S2/c1-5-6(2)20-11-9(5)10(14)15-8(16-11)4-19-3-7(13)12(17)18/h7H,3-4,13H2,1-2H3,(H,17,18)(H2,14,15,16)