3-methyl-5-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[1-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)ethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]-2-thenoic acid Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CC2=C(N(N=C2C)C)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CC2=C(N(N=C2C)C)C)C(=O)O

InChI

InChI=1S/C14H17N3O3S/c1-7-5-12(21-13(7)14(19)20)15-11(18)6-10-8(2)16-17(4)9(10)3/h5H,6H2,1-4H3,(H,15,18)(H,19,20)