2-[2-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-[5-(2-furyl)-3-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[2-[5-(2-furanyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[2-[3-(2-furyl)-5-(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)N2C(CC(=N2)C3=CC=CO3)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)N2C(CC(=N2)C3=CC=CO3)C4=CC=CS4)C

InChI

InChI=1S/C21H18N4O2S2/c1-13-9-14(2)23-21(15(13)11-22)29-12-20(26)25-17(19-6-4-8-28-19)10-16(24-25)18-5-3-7-27-18/h3-9,17H,10,12H2,1-2H3