Vitas-M small molecule compound
4-(1H-benzimidazol-2-ylsulfanyl)-5-nitrobenzene-1,2-dicarbonitrile
Catalog ID
STK661998
SMILES N#Cc1cc(Sc2nc3c([nH]2)cccc3)c(cc1C#N)[N+](=O)[O-]
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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 C15H7N5O2S MW 321.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H7N5O2S/c16-7-9-5-13(20(21)22)14(6-10(9)8-17)23-15-18-11-3-1-2-4-12(11)19-15/h1-6H,(H,18,19)InChIKey
LRTGGNZQUXYRJW-UHFFFAOYSA-NSynonyms
309735-69-1309735691
4(1Hbenzimidazol2ylsulfanyl)5nitrobenzene12dicarbonitrile
4(1HBENZIMIDAZOL2YLSULFANYL)5NITROPHTHALONITRILE
BENZENE12DICARBONITRILE4(2BENZIMIDAZOLYLTHIO)5NITRO
C1=CC=C2C(=C1)NC(=N2)SC3=C(C=C(C(=C3)C#N)C#N)(N+)(=O)(O)
InChI=1SC15H7N5O2Sc1679513(20(21)22)14(610(9)817)23151811312412(11)1915h16H(H1819)
MFCD02110545
N#Cc1cc(Sc2nc3c((nH)2)cccc3)c(cc1C#N)(N+)(=O)(O)
ZINC000000578719
ZINC00578719
ZINC578719
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