3-methyl-5-(3-pyrazol-1-ylpropanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-(3-pyrazol-1-ylpropanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-(3-pyrazol-1-ylpropanoylamino)thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[1-oxo-3-(1-pyrazolyl)propyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-(3-pyrazol-1-ylpropanoylamino)thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-(3-pyrazol-1-ylpropanoylamino)-2-thenoic acid Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CCN2C=CC=N2)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CCN2C=CC=N2)C(=O)O

InChI

InChI=1S/C12H13N3O3S/c1-8-7-10(19-11(8)12(17)18)14-9(16)3-6-15-5-2-4-13-15/h2,4-5,7H,3,6H2,1H3,(H,14,16)(H,17,18)