Vitas-M small molecule compound
(2E)-N-{[4-(acetylsulfamoyl)phenyl]carbamothioyl}-3-(3,4-dimethoxyphenyl)prop-2-enamide
Catalog ID
STK004650
SMILES COc1cc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)NC(=O)C)ccc1OC
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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 C20H21N3O6S2 MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6S2/c1-13(24)23-31(26,27)16-8-6-15(7-9-16)21-20(30)22-19(25)11-5-14-4-10-17(28-2)18(12-14)29-3/h4-12H,1-3H3,(H,23,24)(H2,21,22,25,30)/b11-5+InChIKey
NQNNGUFBSHOBPH-VZUCSPMQSA-NSynonyms
(2E)N((4(ACETYLSULFAMOYL)PHENYL)CARBAMOTHIOYL)3(34DIMETHOXYPHENYL)PROP2ENAMIDE
(E)N((4(ACETYLSULFAMOYL)PHENYL)CARBAMOTHIOYL)3(34DIMETHOXYPHENYL)PROP2ENAMIDE
CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC(=C(C=C2)OC)OC
COc1cc(C=CC(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)NC(=O)C)ccc1OC
InChI=1SC20H21N3O6S2c113(24)2331(2627)168615(7916)2120(30)2219(25)1151441017(282)18(1214)293h412H13H3(H2324)(H221222530)b115+
MFCD03591403
STK004650
ZINC000008916674
ZINC08916674
ZINC8916674
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