Vitas-M small molecule compound
(2E)-3-[(3-butoxyphenyl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK528060
SMILES CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1ccc(cc1)[N+](=O)[O-])\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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-2-3-11-29-20-6-4-5-18(12-20)24-14-17(13-23)22-25-21(15-30-22)16-7-9-19(10-8-16)26(27)28/h4-10,12,14-15,24H,2-3,11H2,1H3/b17-14+InChIKey
RNQWIVVPLJWJET-SAPNQHFASA-NSynonyms
374548-06-8(2E)3((3butoxyphenyl)amino)2(4(4nitrophenyl)13thiazol2yl)prop2enenitrile
(E)3((3butoxyphenyl)amino)2(4(4nitrophenyl)thiazol2yl)acrylonitrile
(E)3(3BUTOXYANILINO)2(4(4NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
374548068
CCCCOC1=CC=CC(=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)(N+)(=O)(O)
CCCCOc1cccc(c1)NC=C(c1scc(n1)c1ccc(cc1)(N+)(=O)(O))C#N
InChI=1SC22H20N4O3Sc12311292064518(1220)241417(1323)222521(153022)167919(10816)26(27)28h41012141524H2311H21H3b1714+
MFCD01956446
ZINC000009339653
ZINC09339653
ZINC9339653
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