1-[(3R)-3-(2-chloranyl-8-methyl-quinolin-3-yl)-5-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[(3R)-3-(2-chloranyl-8-methyl-quinolin-3-yl)-5-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-methyl-propan-1-one Openeye Name: 1-[(3R)-3-(2-chloro-8-methyl-3-quinolyl)-5-(2-furyl)-3,4-dihydropyrazol-2-yl]-2-methyl-propan-1-one CAS Name: 1-[(3R)-3-(2-chloro-8-methyl-3-quinolinyl)-5-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-methyl-1-propanone IUPAC Name: 1-[(3R)-3-(2-chloro-8-methylquinolin-3-yl)-5-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-methylpropan-1-one Traditional Name: 1-[(5R)-5-(2-chloro-8-methyl-3-quinolyl)-3-(2-furyl)-2-pyrazolin-1-yl]-2-methyl-propan-1-one Formula: C21H20ClN3O2 MolecularWeight: 381.8554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)Cl)C3CC(=NN3C(=O)C(C)C)C4=CC=CO4

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)Cl)[C@H]3CC(=NN3C(=O)C(C)C)C4=CC=CO4

InChI

InChI=1S/C21H20ClN3O2/c1-12(2)21(26)25-17(11-16(24-25)18-8-5-9-27-18)15-10-14-7-4-6-13(3)19(14)23-20(15)22/h4-10,12,17H,11H2,1-3H3/t17-/m1/s1