4-azanyl-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 4-azanyl-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-amino-2-(3-ethoxy-3-oxo-propyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-amino-2-[(3-ethoxy-3-oxopropyl)thio]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-amino-2-(3-ethoxy-3-oxopropyl)sulfanyl-5-methylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-amino-2-[(3-ethoxy-3-keto-propyl)thio]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C13H15N3O4S2 MolecularWeight: 341.4059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC(=C2C(=C(SC2=N1)C(=O)O)C)N

Isomeric SMILES

CCOC(=O)CCSC1=NC(=C2C(=C(SC2=N1)C(=O)O)C)N

InChI

InChI=1S/C13H15N3O4S2/c1-3-20-7(17)4-5-21-13-15-10(14)8-6(2)9(12(18)19)22-11(8)16-13/h3-5H2,1-2H3,(H,18,19)(H2,14,15,16)