1-[1-[(5-ethyl-3-methoxycarbonyl-thiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[1-[(5-ethyl-3-methoxycarbonyl-thiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]pyrazole-3-carboxylic acid Openeye Name: 1-[2-[(5-ethyl-3-methoxycarbonyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl]pyrazole-3-carboxylic acid CAS Name: 1-[1-[(5-ethyl-3-methoxycarbonyl-2-thiophenyl)amino]-1-oxopropan-2-yl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[1-[(5-ethyl-3-methoxycarbonylthiophen-2-yl)amino]-1-oxopropan-2-yl]pyrazole-3-carboxylic acid Traditional Name: 1-[2-[(3-carbomethoxy-5-ethyl-2-thienyl)amino]-2-keto-1-methyl-ethyl]pyrazole-3-carboxylic acid Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C(C)N2C=CC(=N2)C(=O)O)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C(C)N2C=CC(=N2)C(=O)O)C(=O)OC

InChI

InChI=1S/C15H17N3O5S/c1-4-9-7-10(15(22)23-3)13(24-9)16-12(19)8(2)18-6-5-11(17-18)14(20)21/h5-8H,4H2,1-3H3,(H,16,19)(H,20,21)