(4-pyrazol-1-ylquinolin-8-yl) 4-methylbenzenesulfonate

Systemtic Name: (4-pyrazol-1-ylquinolin-8-yl) 4-methylbenzenesulfonate Openeye Name: (4-pyrazol-1-yl-8-quinolyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(1-pyrazolyl)-8-quinolinyl] ester IUPAC Name: (4-pyrazol-1-ylquinolin-8-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-pyrazol-1-yl-8-quinolyl) ester Formula: C19H15N3O3S MolecularWeight: 365.4057

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C(C=CN=C32)N4C=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C(C=CN=C32)N4C=CC=N4

InChI

InChI=1S/C19H15N3O3S/c1-14-6-8-15(9-7-14)26(23,24)25-18-5-2-4-16-17(10-12-20-19(16)18)22-13-3-11-21-22/h2-13H,1H3