2-[(1,3-dimethylthieno[2,3-c]pyrazol-5-yl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazol-5-yl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-3-hydroxy-butanoic acid CAS Name: 2-[[(1,3-dimethyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-3-hydroxybutanoic acid Traditional Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-3-hydroxy-butyric acid Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC(C(C)O)C(=O)O)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC(C(C)O)C(=O)O)C

InChI

InChI=1S/C12H15N3O4S/c1-5-7-4-8(20-11(7)15(3)14-5)10(17)13-9(6(2)16)12(18)19/h4,6,9,16H,1-3H3,(H,13,17)(H,18,19)