Vitas-M small molecule compound
3-(4-chloro-3-nitrophenyl)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxopropanenitrile
Catalog ID
STK043255
SMILES N#C/C(=c/1\[nH]c2c([nH]1)cccc2)/C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C16H9ClN4O3 MW 340.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9ClN4O3/c17-11-6-5-9(7-14(11)21(23)24)15(22)10(8-18)16-19-12-3-1-2-4-13(12)20-16/h1-7,19-20HInChIKey
ADEYKCXWLKYLGW-UHFFFAOYSA-NSynonyms
(2Z)2(1HBENZIMIDAZOL2YL)3(4CHLORO3NITROPHENYL)3HYDROXYPROP2ENENITRILE
2(1HBENZIMIDAZOL2YL)3(4CHLORO3NITROPHENYL)3HYDROXYACRYLONITRILE
2(1Hbenzo(d)imidazol2(3H)ylidene)3(4chloro3nitrophenyl)3oxopropanenitrile
3(4CHLORO3NITROPHENYL)2(13DIHYDRO2HBENZIMIDAZOL2YLIDENE)3OXOPROPANENITRILE
3(4CHLORO3NITROPHENYL)2(13DIHYDROBENZIMIDAZOL2YLIDENE)3OXOPROPANENITRILE
3(4CHLORO3NITROPHENYL)2(3HYDROBENZIMIDAZOL2YLIDENE)3OXOPROPANENITRILE
C1=CC=C2C(=C1)NC(=C(C#N)C(=O)C3=CC(=C(C=C3)Cl)(N+)(=O)(O))N2
InChI=1SC16H9ClN4O3c1711659(714(11)21(23)24)15(22)10(818)161912312413(12)2016h171920H
MFCD03176146
N#CC(=c1(nH)c2c((nH)1)cccc2)C(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
STK043255
ZINC000000547314
ZINC00547314
ZINC100505657
ZINC547314
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