(2S)-6-cyano-3-oxidanylidene-2-(2-thiophen-2-ylethanoylamino)-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid

Systemtic Name: (2S)-6-cyano-3-oxidanylidene-2-(2-thiophen-2-ylethanoylamino)-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid Openeye Name: (2S)-6-cyano-3-oxo-2-[[2-(2-thienyl)acetyl]amino]-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid CAS Name: (2S)-6-cyano-3-oxo-2-[(1-oxo-2-thiophen-2-ylethyl)amino]-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid IUPAC Name: (2S)-6-cyano-3-oxo-2-[(2-thiophen-2-ylacetyl)amino]-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid Traditional Name: (2S)-6-cyano-3-keto-2-[[2-(2-thienyl)acetyl]amino]-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid Formula: C14H12N4O4S MolecularWeight: 332.33448

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N2N1CC(=C2C(=O)O)C#N)NC(=O)CC3=CC=CS3

Isomeric SMILES

C1[C@@H](C(=O)N2N1CC(=C2C(=O)O)C#N)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C14H12N4O4S/c15-5-8-6-17-7-10(13(20)18(17)12(8)14(21)22)16-11(19)4-9-2-1-3-23-9/h1-3,10H,4,6-7H2,(H,16,19)(H,21,22)/t10-/m0/s1