Vitas-M small molecule compound
2-(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Catalog ID
STK830829
SMILES N#Cc1c(sc2c1CCCCC2)N1C(=O)C2C(C1=O)CC(=CC2)Cl
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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 C18H17ClN2O2S MW 360.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2O2S/c19-10-6-7-12-13(8-10)17(23)21(16(12)22)18-14(9-20)11-4-2-1-3-5-15(11)24-18/h6,12-13H,1-5,7-8H2InChIKey
RRSKSLDMAKYXOF-UHFFFAOYSA-NSynonyms
333435-38-42(5chloro13dioxo133a477ahexahydro2Hisoindol2yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
2(5chloro13dioxo3a477atetrahydro1Hisoindol2(3H)yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
2(5chloro13dioxo3a477atetrahydroisoindol2yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
333435384
C1CCC2=C(CC1)SC(=C2C#N)N3C(=O)C4CC=C(CC4C3=O)Cl
InChI=1SC18H17ClN2O2Sc1910671213(810)17(23)21(16(12)22)1814(920)114213515(11)2418h61213H1578H2
MFCD01879418
ZINC000000862711
ZINC000100709471
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