Vitas-M small molecule compound
(2Z)-2-(1H-benzimidazol-2-yl)-3-{4-[(5-nitropyridin-2-yl)oxy]phenyl}prop-2-enenitrile
Catalog ID
STK204996
SMILES N#C/C(=C/c1ccc(cc1)Oc1ccc(cn1)[N+](=O)[O-])/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 C21H13N5O3 MW 383.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N5O3/c22-12-15(21-24-18-3-1-2-4-19(18)25-21)11-14-5-8-17(9-6-14)29-20-10-7-16(13-23-20)26(27)28/h1-11,13H,(H,24,25)/b15-11-InChIKey
QVTVYUJYJXNINU-PTNGSMBKSA-NSynonyms
(2Z)2(1HBENZIMIDAZOL2YL)3(4((5NITROPYRIDIN2YL)OXY)PHENYL)PROP2ENENITRILE
(2Z)2BENZIMIDAZOL2YL3(4(5NITRO(2PYRIDYLOXY))PHENYL)PROP2ENENITRILE
(Z)2(1HBENZIMIDAZOL2YL)3(4(5NITROPYRIDIN2YL)OXYPHENYL)PROP2ENENITRILE
C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC=C(C=C3)OC4=NC=C(C=C4)(N+)(=O)(O))C#N
InChI=1SC21H13N5O3c221215(212418312419(18)2521)11145817(9614)292010716(132320)26(27)28h11113H(H2425)b1511
MFCD03013989
N#CC(=Cc1ccc(cc1)Oc1ccc(cn1)(N+)(=O)(O))c1nc2c((nH)1)cccc2
ZINC000004740728
ZINC04740728
ZINC4740728
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