Vitas-M small molecule compound
(8S,8aR,11aS)-N-(4-chlorophenyl)-10-(2,3-dihydro-1,4-benzodioxin-6-yl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Catalog ID
STK543969
SMILES Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)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 C29H22ClN3O5 MW 527.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22ClN3O5/c30-17-5-7-18(8-6-17)31-27(34)26-24-23(25-20-4-2-1-3-16(20)11-12-32(25)26)28(35)33(29(24)36)19-9-10-21-22(15-19)38-14-13-37-21/h1-12,15,23-26H,13-14H2,(H,31,34)/t23-,24+,25?,26-/m0/s1InChIKey
XGWMSKMEYRVRKZ-HLMSNRGBSA-NSynonyms
956917-67-2(8S8aR11aS)N(4chlorophenyl)10(23dihydro14benzodioxin6yl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
(8S8aR11aS)N(4chlorophenyl)10(23dihydrobenzo(b)(14)dioxin6yl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
956917672
C1COC2=C(O1)C=CC(=C2)N3C(=O)C4C(C3=O)C(N5C4C6=CC=CC=C6C=C5)C(=O)NC7=CC=C(C=C7)Cl
Clc1ccc(cc1)NC(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3
InChI=1SC29H22ClN3O5c30175718(8617)3127(34)262423(2520421316(20)111232(25)26)28(35)33(29(24)36)199102122(1519)3814133721h112152326H1314H2(H3134)t2324+25?26m0s1
MFCD18242119
ZINC000100852683
ZINC000100852685
Check stock
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Check stock on Vitas-MAvailable files
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