1-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(4,5-dihydrothiazol-2-ylamino)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-(4,5-dihydrothiazol-2-ylamino)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxoethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(2-thiazolin-2-ylamino)ethyl]pyrazole-4-carboxylic acid Formula: C9H10N4O3S MolecularWeight: 254.2657

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)NC(=O)CN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1CSC(=N1)NC(=O)CN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C9H10N4O3S/c14-7(12-9-10-1-2-17-9)5-13-4-6(3-11-13)8(15)16/h3-4H,1-2,5H2,(H,15,16)(H,10,12,14)