4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]-2-{[2-(methylsulfanyl)ethyl]amino}benzamide (Q27459046)

4-[6,6-Dimethyl-4-Oxo-3-(Trifluoromethyl)-4,5,6,7-Tetrahydro-1h-Indazol-1-Yl]-2-{[2-(Methylsulfanyl)ethyl]amino}benzamide (English)

19 October 2016

chemical formula

C₂₀H₂₃F₃N₄O₂S

1 reference

4-[6,6-Dimethyl-4-Oxo-3-(Trifluoromethyl)-4,5,6,7-Tetrahydro-1h-Indazol-1-Yl]-2-{[2-(Methylsulfanyl)ethyl]amino}benzamide (English)

19 October 2016

canonical SMILES

CC1(CC2=C(C(=O)C1)C(=NN2C3=CC(=C(C=C3)C(=O)N)NCCSC)C(F)(F)F)C

1 reference

4-[6,6-Dimethyl-4-Oxo-3-(Trifluoromethyl)-4,5,6,7-Tetrahydro-1h-Indazol-1-Yl]-2-{[2-(Methylsulfanyl)ethyl]amino}benzamide (English)

InChI=1S/C20H23F3N4O2S/c1-19(2)9-14-16(15(28)10-19)17(20(21,22)23)26-27(14)11-4-5-12(18(24)29)13(8-11)25-6-7-30-3/h4-5,8,25H,6-7,9-10H2,1-3H3,(H2,24,29)

19 October 2016

Identifiers

InChI

1 reference

4-[6,6-Dimethyl-4-Oxo-3-(Trifluoromethyl)-4,5,6,7-Tetrahydro-1h-Indazol-1-Yl]-2-{[2-(Methylsulfanyl)ethyl]amino}benzamide (English)

ISQWIAFSRBRSHC-UHFFFAOYSA-N

19 October 2016

InChIKey

1 reference

4-[6,6-Dimethyl-4-Oxo-3-(Trifluoromethyl)-4,5,6,7-Tetrahydro-1h-Indazol-1-Yl]-2-{[2-(Methylsulfanyl)ethyl]amino}benzamide (English)

19 October 2016

1 reference

4-[6,6-Dimethyl-4-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]-2-{[2-(methylsulfanyl)ethyl]amino}benzamide (English)

19 October 2016

2 references

4-[6,6-Dimethyl-4-Oxo-3-(Trifluoromethyl)-4,5,6,7-Tetrahydro-1h-Indazol-1-Yl]-2-{[2-(Methylsulfanyl)ethyl]amino}benzamide (English)

matched by identifier from

19 October 2016

InChIKey

ISQWIAFSRBRSHC-UHFFFAOYSA-N

1 reference

0 references

1 reference

3Q5K (English)