Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-{4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-3-ethoxyphenyl}prop-2-enenitrile
Catalog ID
STK287273
SMILES CCOc1cc(ccc1OCC(=O)N1CCc2c1cccc2)/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 C28H24N4O3 MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O3/c1-2-34-26-16-19(15-21(17-29)28-30-22-8-4-5-9-23(22)31-28)11-12-25(26)35-18-27(33)32-14-13-20-7-3-6-10-24(20)32/h3-12,15-16H,2,13-14,18H2,1H3,(H,30,31)/b21-15+InChIKey
NZQYXMHGZAQTAF-RCCKNPSSSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(4(2(23dihydro1Hindol1yl)2oxoethoxy)3ethoxyphenyl)prop2enenitrile
(E)2(1Hbenzimidazol2yl)3(4(2(23dihydroindol1yl)2oxoethoxy)3ethoxyphenyl)prop2enenitrile
CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC(=O)N4CCC5=CC=CC=C54
CCOc1cc(ccc1OCC(=O)N1CCc2c1cccc2)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC28H24N4O3c1234261619(1521(1729)283022845923(22)3128)111225(26)351827(33)321413207361024(20)32h3121516H2131418H21H3(H3031)b2115+
MFCD06761527
ZINC000009187397
ZINC09187397
ZINC9187397
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