Vitas-M small molecule compound
(2E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(4-sulfamoylphenyl)prop-2-enamide
Catalog ID
STK473565
SMILES N#C/C(=C\c1cc2OCOc2cc1[N+](=O)[O-])/C(=O)Nc1ccc(cc1)S(=O)(=O)N
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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 C17H12N4O7S MW 416.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O7S/c18-8-11(17(22)20-12-1-3-13(4-2-12)29(19,25)26)5-10-6-15-16(28-9-27-15)7-14(10)21(23)24/h1-7H,9H2,(H,20,22)(H2,19,25,26)/b11-5+InChIKey
SIHRIHPFDNESAE-VZUCSPMQSA-NSynonyms
(2E)2CYANO3(6NITRO(2HBENZO(34D)13DIOXOLAN5YL))N(4SULFAMOYLPHENYL)PROP2ENAMIDE
(2E)2cyano3(6nitro13benzodioxol5yl)N(4sulfamoylphenyl)prop2enamide
(E)2cyano3(6nitro13benzodioxol5yl)N(4sulfamoylphenyl)prop2enamide
C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)(N+)(=O)(O)
InChI=1SC17H12N4O7Sc18811(17(22)20121313(4212)29(1925)26)51061516(2892715)714(10)21(23)24h17H9H2(H2022)(H2192526)b115+
MFCD07092542
N#CC(=Cc1cc2OCOc2cc1(N+)(=O)(O))C(=O)Nc1ccc(cc1)S(=O)(=O)N
ZINC000017090535
ZINC17090535
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