Vitas-M small molecule compound
2-{4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-ethoxyphenoxy}-N-[2-(morpholin-4-yl)phenyl]acetamide
Catalog ID
STK287288
SMILES CCOc1cc(ccc1OCC(=O)Nc1ccccc1N1CCOCC1)/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 C30H29N5O4 MW 523.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O4/c1-2-38-28-18-21(17-22(19-31)30-33-23-7-3-4-8-24(23)34-30)11-12-27(28)39-20-29(36)32-25-9-5-6-10-26(25)35-13-15-37-16-14-35/h3-12,17-18H,2,13-16,20H2,1H3,(H,32,36)(H,33,34)/b22-17+InChIKey
QRYRHQDRZGGNPX-OQKWZONESA-NSynonyms
2(4((E)2(1Hbenzimidazol2yl)2cyanoethenyl)2ethoxyphenoxy)N(2(morpholin4yl)phenyl)acetamide
2(4((E)2(1Hbenzimidazol2yl)2cyanoethenyl)2ethoxyphenoxy)N(2morpholin4ylphenyl)acetamide
CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC(=O)NC4=CC=CC=C4N5CCOCC5
CCOc1cc(ccc1OCC(=O)Nc1ccccc1N1CCOCC1)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC30H29N5O4c1238281821(1722(1931)303323734824(23)3430)111227(28)392029(36)32259561026(25)35131537161435h3121718H2131620H21H3(H3236)(H3334)b2217+
MFCD06761584
ZINC000009187412
ZINC09187412
ZINC9187412
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