Vitas-M small molecule compound
(2E)-N-(4-bromophenyl)-2-cyano-3-(1,2,5-trimethyl-1H-pyrrol-3-yl)prop-2-enamide
Catalog ID
STK051587
SMILES N#C/C(=C\c1cc(n(c1C)C)C)/C(=O)Nc1ccc(cc1)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 C17H16BrN3O MW 358.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN3O/c1-11-8-13(12(2)21(11)3)9-14(10-19)17(22)20-16-6-4-15(18)5-7-16/h4-9H,1-3H3,(H,20,22)/b14-9+InChIKey
XETXZNNFUHQPIS-NTEUORMPSA-NSynonyms
(2E)N(4BROMOPHENYL)2CYANO3(125TRIMETHYL1HPYRROL3YL)PROP2ENAMIDE
(E)N(4BROMOPHENYL)2CYANO3(125TRIMETHYLPYRROL3YL)PROP2ENAMIDE
CC1=CC(=C(N1C)C)C=C(C#N)C(=O)NC2=CC=C(C=C2)Br
InChI=1SC17H16BrN3Oc111813(12(2)21(11)3)914(1019)17(22)20166415(18)5716h49H13H3(H2022)b149+
MFCD03181949
N#CC(=Cc1cc(n(c1C)C)C)C(=O)Nc1ccc(cc1)Br
STK051587
ZINC000002736072
ZINC02736072
ZINC2736072
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