Vitas-M small molecule compound
(3Z)-2-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)buta-1,3-diene-1,1,3-tricarbonitrile
Catalog ID
STK113816
SMILES CCOc1cc(/C=C(/C(=C(C#N)C#N)N)\C#N)cc(c1O)Br
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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 C15H11BrN4O2 MW 359.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrN4O2/c1-2-22-13-5-9(4-12(16)15(13)21)3-10(6-17)14(20)11(7-18)8-19/h3-5,21H,2,20H2,1H3/b10-3+InChIKey
PGSPTJXZUWGWBB-XCVCLJGOSA-NSynonyms
(3Z)2AMINO4(3BROMO5ETHOXY4HYDROXYPHENYL)BUTA13DIENE113TRICARBONITRILE
CCOC1=C(C(=CC(=C1)C=C(C#N)C(=C(C#N)C#N)N)Br)O
CCOc1cc(C=C(C(=C(C#N)C#N)N)C#N)cc(c1O)Br
InChI=1SC15H11BrN4O2c12221359(412(16)15(13)21)310(617)14(20)11(718)819h3521H220H21H3b103+
MFCD03926936
ZINC000097959708
ZINC97959708
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