Vitas-M small molecule compound

(2Z)-3-[2-(butan-2-yloxy)-3-methoxyphenyl]-N-(3-chlorophenyl)-2-cyanoprop-2-enamide

Catalog ID
STK114384
SMILES CCC(Oc1c(cccc1OC)/C=C(\C(=O)Nc1cccc(c1)Cl)/C#N)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 C21H21ClN2O3 MW 384.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O3/c1-4-14(2)27-20-15(7-5-10-19(20)26-3)11-16(13-23)21(25)24-18-9-6-8-17(22)12-18/h5-12,14H,4H2,1-3H3,(H,24,25)/b16-11-
InChIKey
JSGKISAIIPSRKV-WJDWOHSUSA-N
Synonyms

(2Z)3(2(BUTAN2YLOXY)3METHOXYPHENYL)N(3CHLOROPHENYL)2CYANOPROP2ENAMIDE
(Z)3(2butan2yloxy3methoxyphenyl)N(3chlorophenyl)2cyanoprop2enamide
CCC(C)OC1=C(C=CC=C1OC)C=C(C#N)C(=O)NC2=CC(=CC=C2)Cl
CCC(Oc1c(cccc1OC)C=C(C(=O)Nc1cccc(c1)Cl)C#N)C
InChI=1SC21H21ClN2O3c1414(2)272015(751019(20)263)1116(1323)21(25)241896817(22)1218h51214H4H213H3(H2425)b1611
MFCD03649426
ZINC000012628574
ZINC000012628578

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Available files

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