2-chloranyl-3-[(3R)-5-(furan-2-yl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-7-methoxy-quinoline

Systemtic Name: 2-chloranyl-3-[(3R)-5-(furan-2-yl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-7-methoxy-quinoline Openeye Name: 2-chloro-3-[(3R)-5-(2-furyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-7-methoxy-quinoline CAS Name: 2-chloro-3-[(3R)-5-(2-furanyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-7-methoxyquinoline IUPAC Name: 2-chloro-3-[(3R)-5-(furan-2-yl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-7-methoxyquinoline Traditional Name: 2-chloro-3-[(3R)-5-(2-furyl)-2-mesyl-2-pyrazolin-3-yl]-7-methoxy-quinoline Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C3CC(=NN3S(=O)(=O)C)C4=CC=CO4)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)[C@H]3CC(=NN3S(=O)(=O)C)C4=CC=CO4)Cl

InChI

InChI=1S/C18H16ClN3O4S/c1-25-12-6-5-11-8-13(18(19)20-14(11)9-12)16-10-15(17-4-3-7-26-17)21-22(16)27(2,23)24/h3-9,16H,10H2,1-2H3/t16-/m1/s1