4-methylbenzenesulfonic acid; [3-methyl-5-[4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]imidazo[1,2-b][1,2,4]triazol-2-yl]methanol

Systemtic Name: 4-methylbenzenesulfonic acid; [3-methyl-5-[4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]imidazo[1,2-b][1,2,4]triazol-2-yl]methanol Openeye Name: 4-methylbenzenesulfonic acid; [3-methyl-5-[4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]imidazo[1,2-b][1,2,4]triazol-2-yl]methanol CAS Name: 4-methylbenzenesulfonic acid; [3-methyl-5-[4-[1-methyl-5-(trifluoromethyl)-3-pyrazolyl]phenyl]-2-imidazo[1,2-b][1,2,4]triazolyl]methanol IUPAC Name: 4-methylbenzenesulfonic acid; [3-methyl-5-[4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]imidazo[1,2-b][1,2,4]triazol-2-yl]methanol Traditional Name: [3-methyl-5-[4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]imidazo[1,2-b][1,2,4]triazol-2-yl]methanol; tosylic acid Formula: C24H23F3N6O4S MolecularWeight: 548.53743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CN1C(=CC(=N1)C2=CC=C(C=C2)C3=CN4C(=N3)N(C(=N4)CO)C)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CN1C(=CC(=N1)C2=CC=C(C=C2)C3=CN4C(=N3)N(C(=N4)CO)C)C(F)(F)F

InChI

InChI=1S/C17H15F3N6O.C7H8O3S/c1-24-15(9-27)23-26-8-13(21-16(24)26)11-5-3-10(4-6-11)12-7-14(17(18,19)20)25(2)22-12;1-6-2-4-7(5-3-6)11(8,9)10/h3-8,27H,9H2,1-2H3;2-5H,1H3,(H,8,9,10)