2-chloranyl-3-[(3R)-2-ethylsulfonyl-5-phenyl-3,4-dihydropyrazol-3-yl]-6,7-dimethoxy-quinoline

Systemtic Name: 2-chloranyl-3-[(3R)-2-ethylsulfonyl-5-phenyl-3,4-dihydropyrazol-3-yl]-6,7-dimethoxy-quinoline Openeye Name: 2-chloro-3-[(3R)-2-ethylsulfonyl-5-phenyl-3,4-dihydropyrazol-3-yl]-6,7-dimethoxy-quinoline CAS Name: 2-chloro-3-[(3R)-2-ethylsulfonyl-5-phenyl-3,4-dihydropyrazol-3-yl]-6,7-dimethoxyquinoline IUPAC Name: 2-chloro-3-[(3R)-2-ethylsulfonyl-5-phenyl-3,4-dihydropyrazol-3-yl]-6,7-dimethoxyquinoline Traditional Name: 2-chloro-3-[(3R)-2-esyl-5-phenyl-2-pyrazolin-3-yl]-6,7-dimethoxy-quinoline Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=C(N=C4C=C(C(=CC4=C3)OC)OC)Cl

Isomeric SMILES

CCS(=O)(=O)N1[C@H](CC(=N1)C2=CC=CC=C2)C3=C(N=C4C=C(C(=CC4=C3)OC)OC)Cl

InChI

InChI=1S/C22H22ClN3O4S/c1-4-31(27,28)26-19(12-18(25-26)14-8-6-5-7-9-14)16-10-15-11-20(29-2)21(30-3)13-17(15)24-22(16)23/h5-11,13,19H,4,12H2,1-3H3/t19-/m1/s1