About 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile (PubChem CID 157160184) has the molecular formula C161H208N22O20S10
and a molecular weight of 3092.24 g/mol. Its IUPAC name is 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Frequently Asked Questions
What is the IUPAC name of 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
The IUPAC name of 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile (CID 157160184) is 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
What is the SMILES notation for 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
The canonical SMILES for 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile is CC(=O)Nc1ccc(CCSc2nc(N3CC(C)OC(C)C3)c3c(c2C#N)CC(C)(C)OC3)cc1.CC1CN(c2nc(SCCc3ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc3)c(C#N)c3c2COC(C)(C)C3)CC(C)O1.CC1CN(c2nc(SCCc3ccc(N)cc3)c(C#N)c3c2COC(C)(C)C3)CC(C)O1.CC1CN(c2nc(SCCc3ccc(NC(=O)OC(C)(C)C)cc3)c(C#N)c3c2COC(C)(C)C3)CC(C)O1.CC1CN(c2nc(SCCc3cccc(S(C)=O)c3)c(C#N)c3c2COC(C)(C)C3)CC(C)O1.CSc1cccc(CCSc2nc(N3CC(C)OC(C)C3)c3c(c2C#N)CC(C)(C)OC3)c1.
What is the InChIKey of 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
The InChIKey is AMGXQIPZGOGZGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H40N4O4S.C27H36N4O6S3.C27H34N4O3S.C26H33N3O3S2.C26H33N3O2S2.C25H32N4O2S/c1-19-16-34(17-20(2)37-19)26-25-18-36-30(6,7)14-23(25)24(15-31)27(33-26)39-13-12-21-8-10-22(11-9-21)32-28(35)38-29(3,4)5;1-18-15-30(16-19(2)37-18)25-24-17-36-27(3,4)13-22(24)23(14-28)26(29-25)38-12-11-20-7-9-21(10-8-20)31(39(5,32)33)40(6,34)35;1-17-14-31(15-18(2)34-17)25-24-16-33-27(4,5)12-22(24)23(13-28)26(30-25)35-11-10-20-6-8-21(9-7-20)29-19(3)32;1-17-14-29(15-18(2)32-17)24-23-16-31-26(3,4)12-21(23)22(13-27)25(28-24)33-10-9-19-7-6-8-20(11-19)34(5)30;1-17-14-29(15-18(2)31-17)24-23-16-30-26(3,4)12-21(23)22(13-27)25(28-24)33-10-9-19-7-6-8-20(11-19)32-5;1-16-13-29(14-17(2)31-16)23-22-15-30-25(3,4)11-20(22)21(12-26)24(28-23)32-10-9-18-5-7-19(27)8-6-18/h8-11,19-20H,12-14,16-18H2,1-7H3,(H,32,35);7-10,18-19H,11-13,15-17H2,1-6H3;6-9,17-18H,10-12,14-16H2,1-5H3,(H,29,32);6-8,11,17-18H,9-10,12,14-16H2,1-5H3;6-8,11,17-18H,9-10,12,14-16H2,1-5H3;5-8,16-17H,9-11,13-15,27H2,1-4H3.
What are the key properties of 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile has a molecular weight of 3092.24 g/mol, XLogP of 28.59, 37 rotatable bonds, 3 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-aminophenyl)ethylsulfanyl]-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;tert-butyl N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]carbamate;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]acetamide;N-[4-[2-[[5-cyano-8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]-N-methylsulfonylmethanesulfonamide;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfanylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile;8-(2,6-dimethylmorpholin-4-yl)-3,3-dimethyl-6-[2-(3-methylsulfinylphenyl)ethylsulfanyl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile is sourced from PubChem (CID 157160184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).