Vitas-M small molecule compound

4-tert-butyl-N-[2,2,2-trichloro-1-(prop-2-en-1-ylamino)ethyl]benzamide

Catalog ID
STK809111
SMILES C=CCNC(C(Cl)(Cl)Cl)NC(=O)c1ccc(cc1)C(C)(C)C

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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 C16H21Cl3N2O MW 363.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21Cl3N2O/c1-5-10-20-14(16(17,18)19)21-13(22)11-6-8-12(9-7-11)15(2,3)4/h5-9,14,20H,1,10H2,2-4H3,(H,21,22)
InChIKey
SBHNAPZXVVASOF-UHFFFAOYSA-N
Synonyms

4tertbutylN(222trichloro1(prop2en1ylamino)ethyl)benzamide
4TERTBUTYLN(222TRICHLORO1(PROP2ENYLAMINO)ETHYL)BENZAMIDE
CC(C)(C)C1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NCC=C
InChI=1SC16H21Cl3N2Oc15102014(16(1718)19)2113(22)116812(9711)15(23)4h591420H110H224H3(H2122)
MFCD00620324
N(1ALLYLAMINO222TRICHLOROETHYL)4TERTBUTYLBENZAMIDE
ZINC000019315945
ZINC000019315948

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.