1-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-cyclopentylsulfanyl-ethanone

Systemtic Name: 1-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-cyclopentylsulfanyl-ethanone Openeye Name: 1-[(3R)-5-(4-chlorophenyl)-3-(2-furyl)-3,4-dihydropyrazol-2-yl]-2-cyclopentylsulfanyl-ethanone CAS Name: 1-[(3R)-5-(4-chlorophenyl)-3-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-(cyclopentylthio)ethanone IUPAC Name: 1-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-cyclopentylsulfanylethanone Traditional Name: 1-[(5R)-3-(4-chlorophenyl)-5-(2-furyl)-2-pyrazolin-1-yl]-2-(cyclopentylthio)ethanone Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SCC(=O)N2C(CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CO4

Isomeric SMILES

C1CCC(C1)SCC(=O)N2[C@H](CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CO4

InChI

InChI=1S/C20H21ClN2O2S/c21-15-9-7-14(8-10-15)17-12-18(19-6-3-11-25-19)23(22-17)20(24)13-26-16-4-1-2-5-16/h3,6-11,16,18H,1-2,4-5,12-13H2/t18-/m1/s1