2-[(5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]pentanoic acid

Systemtic Name: 2-[(5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]pentanoic acid Openeye Name: 2-[(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)amino]pentanoic acid CAS Name: 2-[[(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-6-yl)-oxomethyl]amino]pentanoic acid IUPAC Name: 2-[(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)amino]pentanoic acid Traditional Name: 2-[(4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carbonyl)amino]valeric acid Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)C1=C(C2=C(S1)N=CNC2=O)C

Isomeric SMILES

CCCC(C(=O)O)NC(=O)C1=C(C2=C(S1)N=CNC2=O)C

InChI

InChI=1S/C13H15N3O4S/c1-3-4-7(13(19)20)16-11(18)9-6(2)8-10(17)14-5-15-12(8)21-9/h5,7H,3-4H2,1-2H3,(H,16,18)(H,19,20)(H,14,15,17)