Vitas-M small molecule compound
2-benzyl-3-(benzylsulfanyl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Catalog ID
STK015110
SMILES O=C1C2=C(C(N1Cc1ccccc1)SCc1ccccc1)CCCC2
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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 C22H23NOS MW 349.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NOS/c24-21-19-13-7-8-14-20(19)22(25-16-18-11-5-2-6-12-18)23(21)15-17-9-3-1-4-10-17/h1-6,9-12,22H,7-8,13-16H2InChIKey
QXFGACCNKVWSDG-UHFFFAOYSA-NSynonyms
2benzyl3(benzylsulfanyl)234567hexahydro1Hisoindol1one
2benzyl3benzylsulfanyl4567tetrahydro3Hisoindol1one
C1CCC2=C(C1)C(N(C2=O)CC3=CC=CC=C3)SCC4=CC=CC=C4
InChI=1SC22H23NOSc24211913781420(19)22(251618115261218)23(21)151793141017h1691222H781316H2
MFCD09959941
O=C1C2=C(C(N1Cc1ccccc1)SCc1ccccc1)CCCC2
STK015110
ZINC000008984277
ZINC000013940105
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