[(3R)-3-(2-chloranyl-6-methyl-quinolin-3-yl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-(furan-2-yl)methanone

Systemtic Name: [(3R)-3-(2-chloranyl-6-methyl-quinolin-3-yl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-(furan-2-yl)methanone Openeye Name: [(3R)-3-(2-chloro-6-methyl-3-quinolyl)-5-(2-thienyl)-1,3-dihydropyrazol-2-yl]-(2-furyl)methanone CAS Name: [(3R)-3-(2-chloro-6-methyl-3-quinolinyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-(2-furanyl)methanone IUPAC Name: [(3R)-3-(2-chloro-6-methylquinolin-3-yl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-(furan-2-yl)methanone Traditional Name: [(5R)-5-(2-chloro-6-methyl-3-quinolyl)-3-(2-thienyl)-3-pyrazolin-1-yl]-(2-furyl)methanone Formula: C22H16ClN3O2S MolecularWeight: 421.89934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)Cl)C3C=C(NN3C(=O)C4=CC=CO4)C5=CC=CS5

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)Cl)[C@H]3C=C(NN3C(=O)C4=CC=CO4)C5=CC=CS5

InChI

InChI=1S/C22H16ClN3O2S/c1-13-6-7-16-14(10-13)11-15(21(23)24-16)18-12-17(20-5-3-9-29-20)25-26(18)22(27)19-4-2-8-28-19/h2-12,18,25H,1H3/t18-/m1/s1