2-[3-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methyl-2-thienyl)amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methyl-2-thiophenyl)amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methylthiophen-2-yl)amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[(5-carbethoxy-3-carbomethoxy-4-methyl-2-thienyl)amino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C17H19N3O7S MolecularWeight: 409.41366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCN2C(=CC=N2)C(=O)O)C(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCN2C(=CC=N2)C(=O)O)C(=O)OC)C

InChI

InChI=1S/C17H19N3O7S/c1-4-27-17(25)13-9(2)12(16(24)26-3)14(28-13)19-11(21)6-8-20-10(15(22)23)5-7-18-20/h5,7H,4,6,8H2,1-3H3,(H,19,21)(H,22,23)