Vitas-M small molecule compound

(2E)-2-cyano-3-[4-(hexyloxy)-3-methoxyphenyl]-N-(4-sulfamoylphenyl)prop-2-enamide

Catalog ID
STK961604
SMILES CCCCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1ccc(cc1)S(=O)(=O)N)\C#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 C23H27N3O5S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O5S/c1-3-4-5-6-13-31-21-12-7-17(15-22(21)30-2)14-18(16-24)23(27)26-19-8-10-20(11-9-19)32(25,28)29/h7-12,14-15H,3-6,13H2,1-2H3,(H,26,27)(H2,25,28,29)/b18-14+
InChIKey
SXNIHPCEKGRLAU-NBVRZTHBSA-N
Synonyms
333438-04-3
(2E)2cyano3(4(hexyloxy)3methoxyphenyl)N(4sulfamoylphenyl)prop2enamide
(2E)2CYANO3(4HEXYLOXY3METHOXYPHENYL)N(4SULFAMOYLPHENYL)PROP2ENAMIDE
(E)2cyano3(4(hexyloxy)3methoxyphenyl)N(4sulfamoylphenyl)acrylamide
(E)2CYANO3(4HEXOXY3METHOXYPHENYL)N(4SULFAMOYLPHENYL)PROP2ENAMIDE
2CYANO3(4HEXYLOXY3METHOXYPHENYL)N(4SULFAMOYLPHENYL)ACRYLAMIDE
333438043
CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)OC
CCCCCCOc1ccc(cc1OC)C=C(C(=O)Nc1ccc(cc1)S(=O)(=O)N)C#N
InChI=1SC23H27N3O5Sc1345613312112717(1522(21)302)1418(1624)23(27)261981020(11919)32(2528)29h7121415H3613H212H3(H2627)(H2252829)b1814+
MFCD02333469
ZINC000001779518
ZINC01779518
ZINC1779518

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Available files

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