About 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide
4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide (PubChem CID 162084330) has the molecular formula C164H143FN40O15S15
and a molecular weight of 3414.22 g/mol. Its IUPAC name is 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide.
Frequently Asked Questions
What is the IUPAC name of 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide (CID 162084330) is 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide is COC(=O)c1ccc(-c2csc(-n3[nH]c(-c4ccccc4)c(/N=N/c4nc(C)c(C)s4)c3=O)n2)cc1.COC(=O)c1nc(/N=N/c2c(-c3ccccc3)[nH]n(-c3nc(-c4ccccc4)cs3)c2=O)sc1C(C)C.Cc1sc(/N=N/c2c(-c3ccccc3)[nH]n(-c3nc(-c4ccccc4)cs3)c2=O)nc1C(=O)N(C)C.O=C(CCCCC1SCC2NC(=O)NC21)CCCSSCCC(=O)CCCCCC(=O)c1ccc(-c2csc(-n3[nH]c(-c4ccccc4)c(/N=N/c4nccs4)c3=O)n2)cc1.O=c1c(/N=N/c2nc3c(s2)CNCC3)c(-c2ccccc2)[nH]n1-c1nc(-c2ccccc2)cs1.O=c1c(/N=N/c2ncc(F)s2)c(-c2ccccc2)[nH]n1-c1nc(-c2ccccc2)cs1.
What is the InChIKey of 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide?
The InChIKey is FVQLBSOGIIIIOC-NUOFBIMXSA-N. The full InChI is InChI=1S/C43H48N8O5S5.C26H22N6O3S2.C25H21N7O2S2.C25H20N6O3S2.C24H19N7OS2.C21H13FN6OS2/c52-31(13-7-8-16-36-38-34(27-58-36)45-41(56)47-38)14-9-23-60-61-24-21-32(53)12-5-2-6-15-35(54)29-19-17-28(18-20-29)33-26-59-43(46-33)51-40(55)39(48-49-42-44-22-25-57-42)37(50-51)30-10-3-1-4-11-30;1-15(2)22-21(24(34)35-3)28-25(37-22)30-29-20-19(17-12-8-5-9-13-17)31-32(23(20)33)26-27-18(14-36-26)16-10-6-4-7-11-16;1-15-19(22(33)31(2)3)27-24(36-15)29-28-21-20(17-12-8-5-9-13-17)30-32(23(21)34)25-26-18(14-35-25)16-10-6-4-7-11-16;1-14-15(2)36-24(26-14)29-28-21-20(17-7-5-4-6-8-17)30-31(22(21)32)25-27-19(13-35-25)16-9-11-18(12-10-16)23(33)34-3;32-22-21(28-29-23-26-17-11-12-25-13-19(17)34-23)20(16-9-5-2-6-10-16)30-31(22)24-27-18(14-33-24)15-7-3-1-4-8-15;22-16-11-23-20(31-16)26-25-18-17(14-9-5-2-6-10-14)27-28(19(18)29)21-24-15(12-30-21)13-7-3-1-4-8-13/h1,3-4,10-11,17-20,22,25-26,34,36,38,50H,2,5-9,12-16,21,23-24,27H2,(H2,45,47,56);4-15,31H,1-3H3;4-14,30H,1-3H3;4-13,30H,1-3H3;1-10,14,25,30H,11-13H2;1-12,27H/b49-48+;30-29+;3*29-28+;26-25+.
What are the key properties of 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide?
4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide has a molecular weight of 3414.22 g/mol, XLogP of 40.63, 54 rotatable bonds, 9 hydrogen bond donors, and 61 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-fluoro-1,3-thiazol-2-yl)diazenyl]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one;methyl 4-[2-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]benzoate;methyl 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-5-propan-2-yl-1,3-thiazole-4-carboxylate;9-[[4-oxo-8-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)octyl]disulfanyl]-1-[4-[2-[3-oxo-5-phenyl-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-2-yl]-1,3-thiazol-4-yl]phenyl]nonane-1,7-dione;5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yldiazenyl)-1H-pyrazol-3-one;N,N,5-trimethyl-2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 162084330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).