About (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline
(1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline (PubChem CID 162155237) has the molecular formula C150H138F6N12O12S6
and a molecular weight of 2607.22 g/mol. Its IUPAC name is (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline.
Frequently Asked Questions
What is the IUPAC name of (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline?
The IUPAC name of (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline (CID 162155237) is (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline.
What is the SMILES notation for (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline?
The canonical SMILES for (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline is Cc1ccc(CS(=O)(=O)N2CCc3ccccc3[C@@H]2c2c[nH]c3ccccc23)cc1.Cc1ccc(CS(=O)(=O)N2CCc3ccccc3[C@H]2c2c[nH]c3ccccc23)cc1.Cc1cccc(CS(=O)(=O)N2CCc3ccccc3[C@@H]2c2c[nH]c3ccccc23)c1.Cc1cccc(CS(=O)(=O)N2CCc3ccccc3[C@H]2c2c[nH]c3ccccc23)c1.O=S(=O)(Cc1ccccc1C(F)(F)F)N1CCc2ccccc2[C@@H]1c1c[nH]c2ccccc12.O=S(=O)(Cc1ccccc1C(F)(F)F)N1CCc2ccccc2[C@H]1c1c[nH]c2ccccc12.
What is the InChIKey of (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline?
The InChIKey is ZLSVOZCSSFVLPS-JFDYKEJASA-N. The full InChI is InChI=1S/2C25H21F3N2O2S.4C25H24N2O2S/c2*26-25(27,28)22-11-5-2-8-18(22)16-33(31,32)30-14-13-17-7-1-3-9-19(17)24(30)21-15-29-23-12-6-4-10-20(21)23;2*1-18-7-6-8-19(15-18)17-30(28,29)27-14-13-20-9-2-3-10-21(20)25(27)23-16-26-24-12-5-4-11-22(23)24;2*1-18-10-12-19(13-11-18)17-30(28,29)27-15-14-20-6-2-3-7-21(20)25(27)23-16-26-24-9-5-4-8-22(23)24/h2*1-12,15,24,29H,13-14,16H2;2*2-12,15-16,25-26H,13-14,17H2,1H3;2*2-13,16,25-26H,14-15,17H2,1H3/t2*24-;4*25-/m101010/s1.
What are the key properties of (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline?
(1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline has a molecular weight of 2607.22 g/mol, XLogP of 31.14, 24 rotatable bonds, 6 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(3-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[(4-methylphenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1S)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline;(1R)-1-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methylsulfonyl]-3,4-dihydro-1H-isoquinoline is sourced from PubChem (CID 162155237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).