About 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide
1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide (PubChem CID 167544882) has the molecular formula C167H164ClFN24O13S6
and a molecular weight of 2962.16 g/mol. Its IUPAC name is 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide.
Frequently Asked Questions
What is the IUPAC name of 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide?
The IUPAC name of 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide (CID 167544882) is 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide.
What is the SMILES notation for 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide?
The canonical SMILES for 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide is C#Cc1ccc(C(=O)N[C@@H]2CCC[C@H](n3c(-c4ccccn4)nc4cc5c(=O)[nH]cnc5cc43)C2)s1.CCC(=O)c1cc2nc(-c3ccccn3)n([C@@H]3CCC[C@H](CC(=O)c4ccc(C)s4)C3)c2cc1C.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2[C@H]1CCC[C@@H](CC(=O)c2sc(C)cc2Cl)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2[C@H]1CCC[C@@H](CC(=O)c2sc(C)cc2F)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2[C@H]1CCC[C@@H](CC(=O)c2sc(C)cc2OC)C1.Cc1ccc(C(=O)N[C@@H]2CCC[C@H](n3c(-c4ccccn4)nc4cc5c(=O)[nH]cnc5cc43)C2)s1.
What is the InChIKey of 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide?
The InChIKey is BQVJLDXWOHGOMZ-QDERABBPSA-N. The full InChI is InChI=1S/C29H31N3O3S.C29H31N3O2S.C28H28ClN3O2S.C28H28FN3O2S.C27H22N6O2S.C26H24N6O2S/c1-4-25(33)20-11-12-24-23(17-20)31-29(22-10-5-6-13-30-22)32(24)21-9-7-8-19(15-21)16-26(34)28-27(35-3)14-18(2)36-28;1-4-26(33)22-17-24-25(14-18(22)2)32(29(31-24)23-10-5-6-13-30-23)21-9-7-8-20(15-21)16-27(34)28-12-11-19(3)35-28;2*1-3-25(33)19-10-11-24-23(16-19)31-28(22-9-4-5-12-30-22)32(24)20-8-6-7-18(14-20)15-26(34)27-21(29)13-17(2)35-27;1-2-18-9-10-24(36-18)27(35)31-16-6-5-7-17(12-16)33-23-14-21-19(26(34)30-15-29-21)13-22(23)32-25(33)20-8-3-4-11-28-20;1-15-8-9-23(35-15)26(34)30-16-5-4-6-17(11-16)32-22-13-20-18(25(33)29-14-28-20)12-21(22)31-24(32)19-7-2-3-10-27-19/h5-6,10-14,17,19,21H,4,7-9,15-16H2,1-3H3;5-6,10-14,17,20-21H,4,7-9,15-16H2,1-3H3;2*4-5,9-13,16,18,20H,3,6-8,14-15H2,1-2H3;1,3-4,8-11,13-17H,5-7,12H2,(H,31,35)(H,29,30,34);2-3,7-10,12-14,16-17H,4-6,11H2,1H3,(H,30,34)(H,28,29,33)/t19-,21+;20-,21+;2*18-,20+;2*16-,17+/m101111/s1.
What are the key properties of 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide?
1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide has a molecular weight of 2962.16 g/mol, XLogP of 38.28, 37 rotatable bonds, 4 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(1S,3R)-3-[2-(3-chloro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-ethynyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide;1-[1-[(1S,3R)-3-[2-(3-fluoro-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[1-[(1S,3R)-3-[2-(3-methoxy-5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;1-[6-methyl-1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;5-methyl-N-[(1R,3S)-3-(8-oxo-2-pyridin-2-yl-7H-imidazo[4,5-g]quinazolin-3-yl)cyclohexyl]thiophene-2-carboxamide is sourced from PubChem (CID 167544882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).