About N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide
N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide (PubChem CID 158592061) has the molecular formula C138H165Cl6N49O8S6
and a molecular weight of 3043.29 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide.
Frequently Asked Questions
What is the IUPAC name of N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide (CID 158592061) is N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide is Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2nc(CC(C)C)nc(N3CCN(CCC#N)CC3)n2)s1.Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2nc(CC(C)C)nc(N3CCN(c4ccncc4)CC3)n2)s1.Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2nc(CC(C)C)nc(N3CCNC(=O)C3)n2)s1.Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2nc(CC(C)C)nc(N3CCNCC3)n2)s1.Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2nc(CC(C)C)nc(NCCN(C)C)n2)s1.Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2nc(CC(C)C)nc(NCCO)n2)s1.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide?
The InChIKey is HUOLGUYOPNNMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30ClN9OS.C25H30ClN9OS.C22H25ClN8O2S.C22H27ClN8OS.C22H29ClN8OS.C20H24ClN7O2S/c1-17(2)15-22-31-25(34-26(32-22)37-13-11-36(12-14-37)19-7-9-29-10-8-19)35-27-30-16-21(39-27)24(38)33-23-18(3)5-4-6-20(23)28;1-16(2)14-20-29-23(32-24(30-20)35-12-10-34(11-13-35)9-5-8-27)33-25-28-15-19(37-25)22(36)31-21-17(3)6-4-7-18(21)26;1-12(2)9-16-26-20(29-21(27-16)31-8-7-24-17(32)11-31)30-22-25-10-15(34-22)19(33)28-18-13(3)5-4-6-14(18)23;1-13(2)11-17-26-20(29-21(27-17)31-9-7-24-8-10-31)30-22-25-12-16(33-22)19(32)28-18-14(3)5-4-6-15(18)23;1-13(2)11-17-26-20(24-9-10-31(4)5)29-21(27-17)30-22-25-12-16(33-22)19(32)28-18-14(3)7-6-8-15(18)23;1-11(2)9-15-24-18(22-7-8-29)27-19(25-15)28-20-23-10-14(31-20)17(30)26-16-12(3)5-4-6-13(16)21/h4-10,16-17H,11-15H2,1-3H3,(H,33,38)(H,30,31,32,34,35);4,6-7,15-16H,5,9-14H2,1-3H3,(H,31,36)(H,28,29,30,32,33);4-6,10,12H,7-9,11H2,1-3H3,(H,24,32)(H,28,33)(H,25,26,27,29,30);4-6,12-13,24H,7-11H2,1-3H3,(H,28,32)(H,25,26,27,29,30);6-8,12-13H,9-11H2,1-5H3,(H,28,32)(H2,24,25,26,27,29,30);4-6,10-11,29H,7-9H2,1-3H3,(H,26,30)(H2,22,23,24,25,27,28).
What are the key properties of N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide?
N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide has a molecular weight of 3043.29 g/mol, XLogP of 25.39, 50 rotatable bonds, 17 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-2-[[4-[4-(2-cyanoethyl)piperazin-1-yl]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-[2-(dimethylamino)ethylamino]-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-hydroxyethylamino)-6-(2-methylpropyl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(3-oxopiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-(2-methylpropyl)-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 158592061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).