ethanoic acid; methyl 5-methyl-2-[(2-methyl-5-oxidanylidene-pyrazolidin-3-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethanoic acid; methyl 5-methyl-2-[(2-methyl-5-oxidanylidene-pyrazolidin-3-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: acetic acid; methyl 5-methyl-2-[(2-methyl-5-oxo-pyrazolidine-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: acetic acid; 5-methyl-2-[[(2-methyl-5-oxo-3-pyrazolidinyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: acetic acid; methyl 5-methyl-2-[(2-methyl-5-oxopyrazolidine-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: acetic acid; 2-[(5-keto-2-methyl-pyrazolidine-3-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C14H19N3O6S MolecularWeight: 357.38216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2CC(=O)NN2C)C(=O)OC.CC(=O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2CC(=O)NN2C)C(=O)OC.CC(=O)O

InChI

InChI=1S/C12H15N3O4S.C2H4O2/c1-6-4-7(12(18)19-3)11(20-6)13-10(17)8-5-9(16)14-15(8)2;1-2(3)4/h4,8H,5H2,1-3H3,(H,13,17)(H,14,16);1H3,(H,3,4)