Vitas-M small molecule compound
8-(1,3-benzodioxol-5-ylcarbonyl)-10-(naphthalen-1-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL344696
SMILES O=C(C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3)c1ccc2c(c1)OCO2
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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 C32H22N2O5 MW 514.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H22N2O5/c35-30(20-12-13-24-25(16-20)39-17-38-24)29-27-26(28-22-10-4-2-7-19(22)14-15-33(28)29)31(36)34(32(27)37)23-11-5-8-18-6-1-3-9-21(18)23/h1-16,26-29H,17H2InChIKey
CSQSRUHFHGIYAE-UHFFFAOYSA-NSynonyms
(8S8aR11aS)8(benzo(d)(13)dioxole5carbonyl)10(naphthalen1yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
8(13benzodioxol5ylcarbonyl)10(naphthalen1yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
C1OC2=C(O1)C=C(C=C2)C(=O)C3C4C(C5N3C=CC6=CC=CC=C56)C(=O)N(C4=O)C7=CC=CC8=CC=CC=C87
InChI=1SC32H22N2O5c3530(2012132425(1620)39173824)292726(28221042719(22)141533(28)29)31(36)34(32(27)37)23115818613921(18)23h1162629H17H2
MFCD28032157
O=C((C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3)c1ccc2c(c1)OCO2
ZINC000015996768
ZINC000101139064
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