Vitas-M small molecule compound

(4E)-N-{[(4-methylphenyl)sulfonyl]oxy}-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-imine

Catalog ID
STK837796
SMILES Cc1ccc(cc1)S(=O)(=O)O/N=C/1\CCCc2c1non2

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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 C13H13N3O4S MW 307.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O4S/c1-9-5-7-10(8-6-9)21(17,18)20-15-12-4-2-3-11-13(12)16-19-14-11/h5-8H,2-4H2,1H3/b15-12+
InChIKey
ITSHUGMYSYPFOY-NTCAYCPXSA-N
Synonyms
352531-22-7
((E)67DIHYDRO5H213BENZOXADIAZOL4YLIDENEAMINO)4METHYLBENZENESULFONATE
(4E)N(((4methylphenyl)sulfonyl)oxy)67dihydro213benzoxadiazol4(5H)imine
(E)67dihydrobenzo(c)(125)oxadiazol4(5H)oneOtosyloxime
352531227
CC1=CC=C(C=C1)S(=O)(=O)ON=C2CCCC3=NON=C32
Cc1ccc(cc1)S(=O)(=O)ON=C1CCCc2c1non2
InChI=1SC13H13N3O4Sc195710(869)21(1718)2015124231113(12)16191411h58H24H21H3b1512+
MFCD00418271
ZINC000004322173
ZINC05363454
ZINC5363454

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Available files

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