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

Systemtic Name: 1-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-[(3R)-5-(4-chlorophenyl)-3-(2-furyl)-3,4-dihydropyrazol-2-yl]-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-[(3R)-5-(4-chlorophenyl)-3-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-[(5R)-3-(4-chlorophenyl)-5-(2-furyl)-2-pyrazolin-1-yl]-2-(2-pyrimidylthio)ethanone Formula: C19H15ClN4O2S MolecularWeight: 398.866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=O)CSC3=NC=CC=N3)C4=CC=CO4

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC=C(C=C2)Cl)C(=O)CSC3=NC=CC=N3)C4=CC=CO4

InChI

InChI=1S/C19H15ClN4O2S/c20-14-6-4-13(5-7-14)15-11-16(17-3-1-10-26-17)24(23-15)18(25)12-27-19-21-8-2-9-22-19/h1-10,16H,11-12H2/t16-/m1/s1