Vitas-M small molecule compound
(2Z)-2-(1H-benzimidazol-2-yl)-3-(3-iodo-5-methoxy-4-propoxyphenyl)prop-2-enenitrile
Catalog ID
STK287704
SMILES CCCOc1c(I)cc(cc1OC)/C=C(\c1nc2c([nH]1)cccc2)/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 C20H18IN3O2 MW 459.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18IN3O2/c1-3-8-26-19-15(21)10-13(11-18(19)25-2)9-14(12-22)20-23-16-6-4-5-7-17(16)24-20/h4-7,9-11H,3,8H2,1-2H3,(H,23,24)/b14-9-InChIKey
LFFTXASFZKNNCV-ZROIWOOFSA-NSynonyms
(2Z)2(1Hbenzimidazol2yl)3(3iodo5methoxy4propoxyphenyl)prop2enenitrile
(Z)2(1HBENZIMIDAZOL2YL)3(3IODO5METHOXY4PROPOXYPHENYL)PROP2ENENITRILE
CCCOC1=C(C=C(C=C1I)C=C(C#N)C2=NC3=CC=CC=C3N2)OC
CCCOc1c(I)cc(cc1OC)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC20H18IN3O2c138261915(21)1013(1118(19)252)914(1222)202316645717(16)2420h47911H38H212H3(H2324)b149
MFCD04214021
ZINC000013943563
ZINC13943563
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