Vitas-M small molecule compound
3-[(4-methyl-3-nitrophenyl)sulfonyl]propanenitrile
Catalog ID
STK177422
SMILES N#CCCS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C
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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 C10H10N2O4S MW 254.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N2O4S/c1-8-3-4-9(7-10(8)12(13)14)17(15,16)6-2-5-11/h3-4,7H,2,6H2,1H3InChIKey
RUCIJSVZLWLREA-UHFFFAOYSA-NSynonyms
90916-01-13((4METHYL3NITROPHENYL)SULFONYL)PROPANENITRILE
3(4METHYL3NITROPHENYL)SULFONYLPROPANENITRILE
90916011
CC1=C(C=C(C=C1)S(=O)(=O)CCC#N)(N+)(=O)(O)
InChI=1SC10H10N2O4Sc18349(710(8)12(13)14)17(1516)62511h347H26H21H3
MFCD01218684
N#CCCS(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000003159360
ZINC03159360
ZINC3159360
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