About N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide
N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide (PubChem CID 159777269) has the molecular formula C111H103ClN34O3S3
and a molecular weight of 2092.93 g/mol. Its IUPAC name is N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide.
Frequently Asked Questions
What is the IUPAC name of N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide?
The IUPAC name of N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide (CID 159777269) is N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide.
What is the SMILES notation for N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide?
The canonical SMILES for N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide is CC(=O)Nc1ccc(Sc2nc(Nn3cc(C)cn3)c3ccccc3n2)cc1.CCc1cnn(Nc2cc(CN(C)C)nc(N(C)c3ccccc3Cl)n2)c1.CN(C)CCOc1ccc2c(Nn3ncc4ccccc43)nc(Nc3ccc(C#N)cc3)nc2c1.Cc1cccc(-c2cc(Nn3ncc4ccccc43)nc(Sc3ccc4ncsc4c3)n2)c1.OCCN(c1ccccc1)c1nc(Nn2ncc3ccccc32)c2[nH]ccc2n1.
What is the InChIKey of N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide?
The InChIKey is NGXFMRVVDRSVED-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N8O.C25H18N6S2.C21H19N7O.C20H18N6OS.C19H24ClN7/c1-33(2)13-14-35-21-11-12-22-23(15-21)30-26(29-20-9-7-18(16-27)8-10-20)31-25(22)32-34-24-6-4-3-5-19(24)17-28-34;1-16-5-4-7-17(11-16)21-13-24(30-31-22-8-3-2-6-18(22)14-27-31)29-25(28-21)33-19-9-10-20-23(12-19)32-15-26-20;29-13-12-27(16-7-2-1-3-8-16)21-24-17-10-11-22-19(17)20(25-21)26-28-18-9-5-4-6-15(18)14-23-28;1-13-11-21-26(12-13)25-19-17-5-3-4-6-18(17)23-20(24-19)28-16-9-7-15(8-10-16)22-14(2)27;1-5-14-11-21-27(12-14)24-18-10-15(13-25(2)3)22-19(23-18)26(4)17-9-7-6-8-16(17)20/h3-12,15,17H,13-14H2,1-2H3,(H2,29,30,31,32);2-15H,1H3,(H,28,29,30);1-11,14,22,29H,12-13H2,(H,24,25,26);3-12H,1-2H3,(H,22,27)(H,23,24,25);6-12H,5,13H2,1-4H3,(H,22,23,24).
What are the key properties of N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide?
N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide has a molecular weight of 2092.93 g/mol, XLogP of 21.87, 31 rotatable bonds, 9 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]indazol-1-amine;2-N-(2-chlorophenyl)-6-[(dimethylamino)methyl]-4-N-(4-ethylpyrazol-1-yl)-2-N-methylpyrimidine-2,4-diamine;4-[[7-[2-(dimethylamino)ethoxy]-4-(indazol-1-ylamino)quinazolin-2-yl]amino]benzonitrile;2-(N-[4-(indazol-1-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]anilino)ethanol;N-[4-[4-[(4-methylpyrazol-1-yl)amino]quinazolin-2-yl]sulfanylphenyl]acetamide is sourced from PubChem (CID 159777269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).