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

Systemtic Name: 2-chloranyl-7-ethoxy-3-[(3R)-5-(furan-2-yl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline Openeye Name: 2-chloro-7-ethoxy-3-[(3R)-5-(2-furyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline CAS Name: 2-chloro-7-ethoxy-3-[(3R)-5-(2-furanyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline IUPAC Name: 2-chloro-7-ethoxy-3-[(3R)-5-(furan-2-yl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline Traditional Name: 2-chloro-7-ethoxy-3-[(3R)-5-(2-furyl)-2-mesyl-2-pyrazolin-3-yl]quinoline Formula: C19H18ClN3O4S MolecularWeight: 419.88192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=NC(=C(C=C2C=C1)C3CC(=NN3S(=O)(=O)C)C4=CC=CO4)Cl

Isomeric SMILES

CCOC1=CC2=NC(=C(C=C2C=C1)[C@H]3CC(=NN3S(=O)(=O)C)C4=CC=CO4)Cl

InChI

InChI=1S/C19H18ClN3O4S/c1-3-26-13-7-6-12-9-14(19(20)21-15(12)10-13)17-11-16(18-5-4-8-27-18)22-23(17)28(2,24)25/h4-10,17H,3,11H2,1-2H3/t17-/m1/s1