2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoylamino]thiophene-3-carboxylic acid

Systemtic Name: 2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoylamino]thiophene-3-carboxylic acid Openeye Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]thiophene-3-carboxylic acid CAS Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]thiophene-3-carboxylic acid Traditional Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3-thenoic acid Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CC(=O)NC2=C(C=CS2)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)CC(=O)NC2=C(C=CS2)C(=O)O

InChI

InChI=1S/C12H13N3O3S/c1-6-9(7(2)15-14-6)5-10(16)13-11-8(12(17)18)3-4-19-11/h3-4H,5H2,1-2H3,(H,13,16)(H,14,15)(H,17,18)