About 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide
1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide (PubChem CID 159531336) has the molecular formula C99H86FN13O8S
and a molecular weight of 1636.92 g/mol. Its IUPAC name is 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide.
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Frequently Asked Questions
What is the IUPAC name of 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide?
The IUPAC name of 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide (CID 159531336) is 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide.
What is the SMILES notation for 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide?
The canonical SMILES for 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide is CCn1c(COc2ccccc2)c(C#N)c2ccc(OC)cc21.COc1ccc(-n2cc(-c3nc(-c4ccccc4)cs3)c3ccc(C(N)=O)cc32)cc1.COc1ccc(-n2cc(C#N)c3ccc(F)cc32)cc1.COc1ccc(-n2cc(C#N)c3ccc(NC(=O)NC(C)(C)C)cc32)cc1.COc1ccc2c(C#N)c(-c3cccc(C)c3)n(C)c2c1.
What is the InChIKey of 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide?
The InChIKey is MDAOEZQHMMMBNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N3O2S.C21H22N4O2.C19H18N2O2.C18H16N2O.C16H11FN2O/c1-30-19-10-8-18(9-11-19)28-14-21(20-12-7-17(24(26)29)13-23(20)28)25-27-22(15-31-25)16-5-3-2-4-6-16;1-21(2,3)24-20(26)23-15-5-10-18-14(12-22)13-25(19(18)11-15)16-6-8-17(27-4)9-7-16;1-3-21-18-11-15(22-2)9-10-16(18)17(12-20)19(21)13-23-14-7-5-4-6-8-14;1-12-5-4-6-13(9-12)18-16(11-19)15-8-7-14(21-3)10-17(15)20(18)2;1-20-14-5-3-13(4-6-14)19-10-11(9-18)15-7-2-12(17)8-16(15)19/h2-15H,1H3,(H2,26,29);5-11,13H,1-4H3,(H2,23,24,26);4-11H,3,13H2,1-2H3;4-10H,1-3H3;2-8,10H,1H3.
What are the key properties of 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide?
1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide has a molecular weight of 1636.92 g/mol, XLogP of 21.76, 17 rotatable bonds, 3 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-3-[3-cyano-1-(4-methoxyphenyl)indol-6-yl]urea;1-ethyl-6-methoxy-2-(phenoxymethyl)indole-3-carbonitrile;6-fluoro-1-(4-methoxyphenyl)indole-3-carbonitrile;6-methoxy-1-methyl-2-(3-methylphenyl)indole-3-carbonitrile;1-(4-methoxyphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)indole-6-carboxamide is sourced from PubChem (CID 159531336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).