Vitas-M small molecule compound
(2Z)-2-(1H-benzimidazol-2-yl)-3-[4-(naphthalen-2-ylmethoxy)phenyl]prop-2-enenitrile
Catalog ID
STK285277
SMILES N#C/C(=C/c1ccc(cc1)OCc1ccc2c(c1)cccc2)/c1nc2c([nH]1)cccc2
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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 C27H19N3O MW 401.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O/c28-17-23(27-29-25-7-3-4-8-26(25)30-27)15-19-10-13-24(14-11-19)31-18-20-9-12-21-5-1-2-6-22(21)16-20/h1-16H,18H2,(H,29,30)/b23-15-InChIKey
KMNZGPLDPRHHMX-HAHDFKILSA-NSynonyms
(2Z)2(1HBENZIMIDAZOL2YL)3(4(NAPHTHALEN2YLMETHOXY)PHENYL)PROP2ENENITRILE
(Z)2(1HBENZIMIDAZOL2YL)3(4(NAPHTHALEN2YLMETHOXY)PHENYL)PROP2ENENITRILE
C1=CC=C2C=C(C=CC2=C1)COC3=CC=C(C=C3)C=C(C#N)C4=NC5=CC=CC=C5N4
InChI=1SC27H19N3Oc281723(272925734826(25)3027)1519101324(141119)31182091221512622(21)1620h116H18H2(H2930)b2315
MFCD05992179
N#CC(=Cc1ccc(cc1)OCc1ccc2c(c1)cccc2)c1nc2c((nH)1)cccc2
ZINC000005042109
ZINC05042109
ZINC5042109
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