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

Systemtic Name: 4-azanyl-2-[(1,3-dimethylthieno[2,3-c]pyrazol-5-yl)carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[(1,3-dimethyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[(1,3-dimethylthieno[2,3-c]pyrazole-5-carbonyl)amino]-4-keto-butyric acid Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O4S/c1-5-6-3-8(21-11(6)16(2)15-5)10(18)14-7(12(19)20)4-9(13)17/h3,7H,4H2,1-2H3,(H2,13,17)(H,14,18)(H,19,20)