1-[(3R)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(furan-2-ylmethylsulfanyl)ethanone

Systemtic Name: 1-[(3R)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(furan-2-ylmethylsulfanyl)ethanone Openeye Name: 1-[(3R)-3-(2,3-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-(2-furylmethylsulfanyl)ethanone CAS Name: 1-[(3R)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-furanylmethylthio)ethanone IUPAC Name: 1-[(3R)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(furan-2-ylmethylsulfanyl)ethanone Traditional Name: 1-[(5R)-5-(2,3-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-(2-furfurylthio)ethanone Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2CC(=NN2C(=O)CSCC3=CC=CO3)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1OC)[C@H]2CC(=NN2C(=O)CSCC3=CC=CO3)C4=CC=CS4

InChI

InChI=1S/C22H22N2O4S2/c1-26-19-8-3-7-16(22(19)27-2)18-12-17(20-9-5-11-30-20)23-24(18)21(25)14-29-13-15-6-4-10-28-15/h3-11,18H,12-14H2,1-2H3/t18-/m1/s1