Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-[3-ethoxy-4-(propan-2-yloxy)phenyl]prop-2-enenitrile
Catalog ID
STK287646
SMILES CCOc1cc(ccc1OC(C)C)/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 C21H21N3O2 MW 347.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O2/c1-4-25-20-12-15(9-10-19(20)26-14(2)3)11-16(13-22)21-23-17-7-5-6-8-18(17)24-21/h5-12,14H,4H2,1-3H3,(H,23,24)/b16-11+InChIKey
OWILNDKFPGLFCD-LFIBNONCSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(3ethoxy4(propan2yloxy)phenyl)prop2enenitrile
(2E)2BENZIMIDAZOL2YL3(3ETHOXY4(METHYLETHOXY)PHENYL)PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(3ETHOXY4PROPAN2YLOXYPHENYL)PROP2ENENITRILE
2(1HBENZOIMIDAZOL2YL)3(3ETHOXY4ISOPROPOXYPHENYL)ACRYLONITRILE
CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OC(C)C
CCOc1cc(ccc1OC(C)C)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC21H21N3O2c1425201215(91019(20)2614(2)3)1116(1322)212317756818(17)2421h51214H4H213H3(H2324)b1611+
MFCD03996516
ZINC000004453123
ZINC04453123
ZINC4453123
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