Vitas-M small molecule compound
(3R,3aS,7aR)-6-chloro-3-hydroxy-2-[2-(1H-indol-3-yl)ethyl]-2,3,3a,4,7,7a-hexahydro-1H-isoindol-1-one
Catalog ID
STK741151
SMILES ClC1=CC[C@H]2[C@@H](C1)C(=O)N([C@@H]2O)CCc1c[nH]c2c1cccc2
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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 C18H19ClN2O2 MW 330.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN2O2/c19-12-5-6-14-15(9-12)18(23)21(17(14)22)8-7-11-10-20-16-4-2-1-3-13(11)16/h1-5,10,14-15,17,20,22H,6-9H2/t14-,15+,17+/m0/s1InChIKey
GTSSFWMEJWKPIJ-ZMSDIMECSA-NSynonyms
(3R3aS7aR)2(2(1Hindol3yl)ethyl)6chloro3hydroxy233a477ahexahydro1Hisoindol1one
(3R3aS7aR)6chloro3hydroxy2(2(1Hindol3yl)ethyl)233a477ahexahydro1Hisoindol1one
(3R3aS7aR)6chloro3hydroxy2(2(1Hindol3yl)ethyl)3a477atetrahydro3Hisoindol1one
C1C=C(CC2C1C(N(C2=O)CCC3=CNC4=CC=CC=C43)O)Cl
ClC1=CC(C@H)2(C@@H)(C1)C(=O)N((C@@H)2O)CCc1c(nH)c2c1cccc2
InChI=1SC18H19ClN2O2c1912561415(912)18(23)21(17(14)22)8711102016421313(11)16h15101415172022H69H2t1415+17+m0s1
MFCD13371859
ZINC000004834762
ZINC04834762
ZINC4834762
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