Vitas-M small molecule compound
10-[4-chloro-3-(trifluoromethyl)phenyl]-8-[(3,4-dimethoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL041362
SMILES COc1ccc(cc1OC)C(=O)C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1ccc(c(c1)C(F)(F)F)Cl)cccc3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H22ClF3N2O5 MW 582.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22ClF3N2O5/c1-40-21-10-7-16(13-22(21)41-2)27(37)26-24-23(25-18-6-4-3-5-15(18)11-12-35(25)26)28(38)36(29(24)39)17-8-9-20(31)19(14-17)30(32,33)34/h3-14,23-26H,1-2H3InChIKey
YGFFVYYXYWZYBD-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10(4chloro3(trifluoromethyl)phenyl)8(34dimethoxybenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
10(4chloro3(trifluoromethyl)phenyl)8((34dimethoxyphenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC(=C(C=C6)Cl)C(F)(F)F)OC
COc1ccc(cc1OC)C(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(c(c1)C(F)(F)F)Cl)cccc3
InChI=1SC30H22ClF3N2O5c1402110716(1322(21)412)27(37)262423(2518643515(18)111235(25)26)28(38)36(29(24)39)178920(31)19(1417)30(3233)34h3142326H12H3
MFCD05729578
ZINC000101672253
ZINC000245247851
Check stock
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Check stock on Vitas-MAvailable files
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