Vitas-M small molecule compound

(2Z)-3-[4-(benzyloxy)-3-methoxyphenyl]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STK553190
SMILES N#C/C(=C/c1ccc(c(c1)OC)OCc1ccccc1)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

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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 C26H19N3O4S MW 469.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O4S/c1-32-25-13-19(10-11-24(25)33-16-18-6-3-2-4-7-18)12-21(15-27)26-28-23(17-34-26)20-8-5-9-22(14-20)29(30)31/h2-14,17H,16H2,1H3/b21-12-
InChIKey
PBGWGANVKIRAQJ-MTJSOVHGSA-N
Synonyms
333414-03-2
(2Z)3(3METHOXY4(PHENYLMETHOXY)PHENYL)2(4(3NITROPHENYL)(13THIAZOL2YL))PROP2ENENITRILE
(2Z)3(4(benzyloxy)3methoxyphenyl)2(4(3nitrophenyl)13thiazol2yl)prop2enenitrile
(Z)3(3METHOXY4PHENYLMETHOXYPHENYL)2(4(3NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
(Z)3(4(benzyloxy)3methoxyphenyl)2(4(3nitrophenyl)thiazol2yl)acrylonitrile
3(4(BENZYLOXY)3METHOXYPHENYL)2(4(3NITROPHENYL)13THIAZOL2YL)ACRYLONITRILE
333414032
COC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)(N+)(=O)(O))OCC4=CC=CC=C4
InChI=1SC26H19N3O4Sc132251319(101124(25)3316186324718)1221(1527)262823(173426)2085922(1420)29(30)31h21417H16H21H3b2112
MFCD02734169
N#CC(=Cc1ccc(c(c1)OC)OCc1ccccc1)c1scc(n1)c1cccc(c1)(N+)(=O)(O)
ZINC000006906959
ZINC06906959
ZINC6906959

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Available files

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