Vitas-M small molecule compound

N-{4-[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl}-4-tert-butylbenzamide

Catalog ID
STK535361
SMILES O=C(c1ccc(cc1)NC(=O)c1ccc(cc1)C(C)(C)C)/C=C/c1ccc2c(c1)OCO2

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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 C27H25NO4 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO4/c1-27(2,3)21-10-6-20(7-11-21)26(30)28-22-12-8-19(9-13-22)23(29)14-4-18-5-15-24-25(16-18)32-17-31-24/h4-16H,17H2,1-3H3,(H,28,30)/b14-4+
InChIKey
PTJPHWXNWPBHDJ-LNKIKWGQSA-N
Synonyms
374094-21-0
(E)N(4(3(benzo(d)(13)dioxol5yl)acryloyl)phenyl)4(tertbutyl)benzamide
374094210
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)C=CC3=CC4=C(C=C3)OCO4
InChI=1SC27H25NO4c127(23)2110620(71121)26(30)282212819(91322)23(29)144185152425(1618)32173124h416H17H213H3(H2830)b144+
MFCD01853248
N(4((2E)3(13benzodioxol5yl)prop2enoyl)phenyl)4tertbutylbenzamide
N(4((E)3(13BENZODIOXOL5YL)PROP2ENOYL)PHENYL)4TERTBUTYLBENZAMIDE
O=C(c1ccc(cc1)NC(=O)c1ccc(cc1)C(C)(C)C)C=Cc1ccc2c(c1)OCO2
ZINC000013774249
ZINC13774249

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Available files

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