1-[(3S)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[(3S)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[(3S)-3-(2-furyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-3-(2-furanyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[(3S)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(benzylthio)-1-[(5S)-5-(2-furyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C20H18N2O2S2 MolecularWeight: 382.49912

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=O)CSCC3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

C1[C@H](N(N=C1C2=CC=CS2)C(=O)CSCC3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C20H18N2O2S2/c23-20(14-25-13-15-6-2-1-3-7-15)22-17(18-8-4-10-24-18)12-16(21-22)19-9-5-11-26-19/h1-11,17H,12-14H2/t17-/m0/s1