4-oxidanylidene-4-(5-pyrazol-1-ylthiophen-2-yl)butanoic acid

Systemtic Name: 4-oxidanylidene-4-(5-pyrazol-1-ylthiophen-2-yl)butanoic acid Openeye Name: 4-oxo-4-(5-pyrazol-1-yl-2-thienyl)butanoic acid CAS Name: 4-oxo-4-[5-(1-pyrazolyl)-2-thiophenyl]butanoic acid IUPAC Name: 4-oxo-4-(5-pyrazol-1-ylthiophen-2-yl)butanoic acid Traditional Name: 4-keto-4-(5-pyrazol-1-yl-2-thienyl)butyric acid Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(S2)C(=O)CCC(=O)O

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(S2)C(=O)CCC(=O)O

InChI

InChI=1S/C11H10N2O3S/c14-8(2-5-11(15)16)9-3-4-10(17-9)13-7-1-6-12-13/h1,3-4,6-7H,2,5H2,(H,15,16)