About tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate
tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate (PubChem CID 165090436) has the molecular formula C94H111ClF15IN20O14S2
and a molecular weight of 2256.51 g/mol. Its IUPAC name is tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate.
Frequently Asked Questions
What is the IUPAC name of tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate?
The IUPAC name of tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate (CID 165090436) is tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate.
What is the SMILES notation for tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate?
The canonical SMILES for tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate is C.C.C.C.CC(C)(C)OC(=O)NC1CN(c2ccc(C#N)c(C(F)(F)F)c2)C1.CC(C)(C)OC(=O)NC1CNC1.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)Cl)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)NC4CN(c5ccc(C#N)c(C(F)(F)F)c5)C4)ccc3OCC)nn12.N#Cc1ccc(I)cc1C(F)(F)F.N#Cc1ccc(N2CC([NH3+])C2)cc1C(F)(F)F.O=C([O-])C(F)(F)F.
What is the InChIKey of tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate?
The InChIKey is XOQQQPBKADVTCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28F3N7O4S.C17H19ClN4O4S.C16H18F3N3O2.C11H10F3N3.C8H3F3IN.C8H16N2O2.C2HF3O2.4CH4/c1-4-6-24-33-16(3)25-27(39)34-26(35-38(24)25)21-12-20(9-10-23(21)42-5-2)43(40,41)36-18-14-37(15-18)19-8-7-17(13-32)22(11-19)28(29,30)31;1-4-6-14-19-10(3)15-17(23)20-16(21-22(14)15)12-9-11(27(18,24)25)7-8-13(12)26-5-2;1-15(2,3)24-14(23)21-11-8-22(9-11)12-5-4-10(7-20)13(6-12)16(17,18)19;12-11(13,14)10-3-9(2-1-7(10)4-15)17-5-8(16)6-17;9-8(10,11)7-3-6(12)2-1-5(7)4-13;1-8(2,3)12-7(11)10-6-4-9-5-6;3-2(4,5)1(6)7;;;;/h7-12,18,36H,4-6,14-15H2,1-3H3,(H,34,35,39);7-9H,4-6H2,1-3H3,(H,20,21,23);4-6,11H,8-9H2,1-3H3,(H,21,23);1-3,8H,5-6,16H2;1-3H;6,9H,4-5H2,1-3H3,(H,10,11);(H,6,7);4*1H4.
What are the key properties of tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate?
tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate has a molecular weight of 2256.51 g/mol, XLogP of 16.28, 19 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(azetidin-3-yl)carbamate;tert-butyl N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]carbamate;[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]azanium;N-[1-[4-cyano-3-(trifluoromethyl)phenyl]azetidin-3-yl]-4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonamide;4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)benzenesulfonyl chloride;4-iodo-2-(trifluoromethyl)benzonitrile;methane;2,2,2-trifluoroacetate is sourced from PubChem (CID 165090436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).