2-chloranyl-3-[(3S)-5-(4-methoxyphenyl)-2-methylsulfonyl-1,3-dihydropyrazol-3-yl]quinoline

Systemtic Name: 2-chloranyl-3-[(3S)-5-(4-methoxyphenyl)-2-methylsulfonyl-1,3-dihydropyrazol-3-yl]quinoline Openeye Name: 2-chloro-3-[(3S)-5-(4-methoxyphenyl)-2-methylsulfonyl-1,3-dihydropyrazol-3-yl]quinoline CAS Name: 2-chloro-3-[(3S)-5-(4-methoxyphenyl)-2-methylsulfonyl-1,3-dihydropyrazol-3-yl]quinoline IUPAC Name: 2-chloro-3-[(3S)-5-(4-methoxyphenyl)-2-methylsulfonyl-1,3-dihydropyrazol-3-yl]quinoline Traditional Name: 2-chloro-3-[(3S)-2-mesyl-5-(4-methoxyphenyl)-3-pyrazolin-3-yl]quinoline Formula: C20H18ClN3O3S MolecularWeight: 415.89322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(N(N2)S(=O)(=O)C)C3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=C[C@H](N(N2)S(=O)(=O)C)C3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C20H18ClN3O3S/c1-27-15-9-7-13(8-10-15)18-12-19(24(23-18)28(2,25)26)16-11-14-5-3-4-6-17(14)22-20(16)21/h3-12,19,23H,1-2H3/t19-/m0/s1