Vitas-M small molecule compound
(2E)-N-(3-bromophenyl)-2-cyano-3-[1-(cyanomethyl)-1H-indol-3-yl]prop-2-enamide
Catalog ID
STK186040
SMILES N#CCn1cc(c2c1cccc2)/C=C(/C(=O)Nc1cccc(c1)Br)\C#N
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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 C20H13BrN4O MW 405.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrN4O/c21-16-4-3-5-17(11-16)24-20(26)14(12-23)10-15-13-25(9-8-22)19-7-2-1-6-18(15)19/h1-7,10-11,13H,9H2,(H,24,26)/b14-10+InChIKey
ZOWNYDKVDUOKRC-GXDHUFHOSA-NSynonyms
(2E)N(3BROMOPHENYL)2CYANO3(1(CYANOMETHYL)1HINDOL3YL)PROP2ENAMIDE
(E)N(3BROMOPHENYL)2CYANO3(1(CYANOMETHYL)INDOL3YL)PROP2ENAMIDE
C1=CC=C2C(=C1)C(=CN2CC#N)C=C(C#N)C(=O)NC3=CC(=CC=C3)Br
InChI=1SC20H13BrN4Oc211643517(1116)2420(26)14(1223)10151325(9822)19721618(15)19h17101113H9H2(H2426)b1410+
MFCD02379433
N#CCn1cc(c2c1cccc2)C=C(C(=O)Nc1cccc(c1)Br)C#N
ZINC000001211415
ZINC01211415
ZINC1211415
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