Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-ylamino)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK837789
SMILES CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc2c(c1)OCO2)/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 C21H17N3O3S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O3S/c1-2-25-17-6-3-14(4-7-17)18-12-28-21(24-18)15(10-22)11-23-16-5-8-19-20(9-16)27-13-26-19/h3-9,11-12,23H,2,13H2,1H3/b15-11+InChIKey
CBUFXKLPRIUNIY-RVDMUPIBSA-NSynonyms
378206-22-5(2E)3(13benzodioxol5ylamino)2(4(4ethoxyphenyl)13thiazol2yl)prop2enenitrile
(E)3(13BENZODIOXOL5YLAMINO)2(4(4ETHOXYPHENYL)13THIAZOL2YL)PROP2ENENITRILE
(E)3(benzo(d)(13)dioxol5ylamino)2(4(4ethoxyphenyl)thiazol2yl)acrylonitrile
378206225
CCOC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)OCO4)C#N
CCOc1ccc(cc1)c1csc(n1)C(=CNc1ccc2c(c1)OCO2)C#N
InChI=1SC21H17N3O3Sc1225176314(4717)18122821(2418)15(1022)112316581920(916)27132619h39111223H213H21H3b1511+
MFCD02984316
ZINC000001295695
ZINC01295695
ZINC1295695
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