2-[(1,3-dimethylthieno[2,3-c]pyrazol-5-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazol-5-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(1,3-dimethyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-4-(methylthio)butyric acid Formula: C13H17N3O3S2 MolecularWeight: 327.42238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3S2/c1-7-8-6-10(21-12(8)16(2)15-7)11(17)14-9(13(18)19)4-5-20-3/h6,9H,4-5H2,1-3H3,(H,14,17)(H,18,19)