Vitas-M small molecule compound
4-nitrophenyl N-(2-cyanopropan-2-yl)-4-methylbenzenesulfonimidate
Catalog ID
STK524963
SMILES N#CC(N=S(=O)(c1ccc(cc1)C)Oc1ccc(cc1)[N+](=O)[O-])(C)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 C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-13-4-10-16(11-5-13)25(23,19-17(2,3)12-18)24-15-8-6-14(7-9-15)20(21)22/h4-11H,1-3H3InChIKey
WKJANNHKONLOTN-UHFFFAOYSA-NSynonyms
16213-58-416213584
2METHYL2(((4METHYLPHENYL)(4NITROPHENOXY)OXO
2methyl2(((4methylphenyl)(4nitrophenoxy)oxo$l^(6)sulfanylidene)amino)propanenitrile
4nitrophenylN(2cyanopropan2yl)4methylbenzenesulfonimidate
CC1=CC=C(C=C1)S(=NC(C)(C)C#N)(=O)OC2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC17H17N3O4Sc11341016(11513)25(231917(23)1218)24158614(7915)20(21)22h411H13H3
MFCD00540725
N#CC(N=S(=O)(c1ccc(cc1)C)Oc1ccc(cc1)(N+)(=O)(O))(C)C
ZINC000013757334
ZINC000100703284
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