Vitas-M small molecule compound
3-methylbutyl (2Z)-2-cyano-3-(1H-indol-3-yl)prop-2-enoate
Catalog ID
STL120664
SMILES N#C/C(=C/c1c[nH]c2c1cccc2)/C(=O)OCCC(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 C17H18N2O2 MW 282.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O2/c1-12(2)7-8-21-17(20)13(10-18)9-14-11-19-16-6-4-3-5-15(14)16/h3-6,9,11-12,19H,7-8H2,1-2H3/b13-9-InChIKey
SJLJYDTYSXNOFR-LCYFTJDESA-NSynonyms
(E)isopentyl2cyano3(1Hindol3yl)acrylate
3methylbutyl(2Z)2cyano3(1Hindol3yl)prop2enoate
3METHYLBUTYL(2Z)2CYANO3INDOL3YLPROP2ENOATE
3methylbutyl(Z)2cyano3(1Hindol3yl)prop2enoate
CC(C)CCOC(=O)C(=CC1=CNC2=CC=CC=C21)C#N
InChI=1SC17H18N2O2c112(2)782117(20)13(1018)914111916643515(14)16h369111219H78H212H3b139
MFCD07429021
N#CC(=Cc1c(nH)c2c1cccc2)C(=O)OCCC(C)C
ZINC000026920717
ZINC26920717
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