Vitas-M small molecule compound
4-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-5-nitrobenzene-1,2-dicarbonitrile
Catalog ID
STK778545
SMILES N#Cc1cc(Sc2nnc3c(n2)n(C)c2c3cccc2)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 C18H9N7O2S MW 387.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H9N7O2S/c1-24-13-5-3-2-4-12(13)16-17(24)21-18(23-22-16)28-15-7-11(9-20)10(8-19)6-14(15)25(26)27/h2-7H,1H3InChIKey
MNTFGAJVSSGHKC-UHFFFAOYSA-NSynonyms
4((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)5NITROBENZENE12DICARBONITRILE
4((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)5nitrobenzene12dicarbonitrile
5(5METHYL(124TRIAZINO(56B)INDOL3YLTHIO))4NITROBENZENE12DICARBONITRILE
CN1C2=CC=CC=C2C3=C1N=C(N=N3)SC4=C(C=C(C(=C4)C#N)C#N)(N+)(=O)(O)
InChI=1SC18H9N7O2Sc12413532412(13)1617(24)2118(232216)2815711(920)10(819)614(15)25(26)27h27H1H3
MFCD05856777
N#Cc1cc(Sc2nnc3c(n2)n(C)c2c3cccc2)c(cc1C#N)(N+)(=O)(O)
ZINC000004698211
ZINC04698211
ZINC4698211
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