Vitas-M small molecule compound
(2E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK535839
SMILES CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1cc2OCOc2cc1C(=O)C)/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 C23H19N3O4S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4S/c1-3-28-17-6-4-15(5-7-17)20-12-31-23(26-20)16(10-24)11-25-19-9-22-21(29-13-30-22)8-18(19)14(2)27/h4-9,11-12,25H,3,13H2,1-2H3/b16-11+InChIKey
QMGYJAWUHNFRGQ-LFIBNONCSA-NSynonyms
(2E)3((6acetyl13benzodioxol5yl)amino)2(4(4ethoxyphenyl)13thiazol2yl)prop2enenitrile
(E)3((6ACETYL13BENZODIOXOL5YL)AMINO)2(4(4ETHOXYPHENYL)13THIAZOL2YL)PROP2ENENITRILE
(E)3((6acetylbenzo(d)(13)dioxol5yl)amino)2(4(4ethoxyphenyl)thiazol2yl)acrylonitrile
CCOC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC4=C(C=C3C(=O)C)OCO4)C#N
CCOc1ccc(cc1)c1csc(n1)C(=CNc1cc2OCOc2cc1C(=O)C)C#N
InChI=1SC23H19N3O4Sc1328176415(5717)20123123(2620)16(1024)11251992221(29133022)818(19)14(2)27h49111225H313H212H3b1611+
MFCD02984627
ZINC000001242947
ZINC01242947
ZINC1242947
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