4-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid CAS Name: 4-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-4-oxobutanoic acid IUPAC Name: 4-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-4-oxobutanoic acid Traditional Name: 4-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-4-keto-butyric acid Formula: C15H14N2O3S2 MolecularWeight: 334.41326

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=O)CCC(=O)O)C3=CC=CS3

Isomeric SMILES

C1C(N(N=C1C2=CC=CS2)C(=O)CCC(=O)O)C3=CC=CS3

InChI

InChI=1S/C15H14N2O3S2/c18-14(5-6-15(19)20)17-11(13-4-2-8-22-13)9-10(16-17)12-3-1-7-21-12/h1-4,7-8,11H,5-6,9H2,(H,19,20)