Vitas-M small molecule compound

2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-1H-isoindole-1,3(2H)-dione

Catalog ID
STK119600
SMILES O=C1N(CSc2nc3c(o2)cccc3)C(=O)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 C16H10N2O3S MW 310.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O3S/c19-14-10-5-1-2-6-11(10)15(20)18(14)9-22-16-17-12-7-3-4-8-13(12)21-16/h1-8H,9H2
InChIKey
VOGZFYZINGMYIT-UHFFFAOYSA-N
Synonyms
311314-46-2
2((13BENZOXAZOL2YLSULFANYL)METHYL)1HISOINDOLE13(2H)DIONE
2(13BENZOXAZOL2YLSULFANYLMETHYL)ISOINDOLE13DIONE
2(BENZOXAZOL2YLTHIOMETHYL)BENZO(C)AZOLINE13DIONE
311314462
C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=NC4=CC=CC=C4O3
InChI=1SC16H10N2O3Sc191410512611(10)15(20)18(14)922161712734813(12)2116h18H9H2
MFCD00825381
ZINC000003117559
ZINC03117559
ZINC3117559

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.