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

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)-1-[(3R)-3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(2-furylmethylsulfanyl)-1-[(3R)-3-(p-tolyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(2-furanylmethylthio)-1-[(3R)-3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(furan-2-ylmethylsulfanyl)-1-[(3R)-3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(2-furfurylthio)-1-[(5R)-5-(p-tolyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSCC3=CC=CO3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2CC(=NN2C(=O)CSCC3=CC=CO3)C4=CC=CS4

InChI

InChI=1S/C21H20N2O2S2/c1-15-6-8-16(9-7-15)19-12-18(20-5-3-11-27-20)22-23(19)21(24)14-26-13-17-4-2-10-25-17/h2-11,19H,12-14H2,1H3/t19-/m1/s1