[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl] 2-methylpropanoate

Systemtic Name: [2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl] 2-methylpropanoate Openeye Name: [2-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxoethyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl] ester Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)OCC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC=CS3

InChI

InChI=1S/C17H18N2O3S2/c1-11(2)17(21)22-10-16(20)19-13(15-6-4-8-24-15)9-12(18-19)14-5-3-7-23-14/h3-8,11,13H,9-10H2,1-2H3