Vitas-M small molecule compound
6-tert-butyl-2-{[(E)-(4-nitrothiophen-2-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK753232
SMILES N#Cc1c(/N=C/c2scc(c2)[N+](=O)[O-])sc2c1CCC(C2)C(C)(C)C
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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 C18H19N3O2S2 MW 373.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2S2/c1-18(2,3)11-4-5-14-15(8-19)17(25-16(14)6-11)20-9-13-7-12(10-24-13)21(22)23/h7,9-11H,4-6H2,1-3H3/b20-9+InChIKey
SMPIETSCWJTFFZ-AWQFTUOYSA-NSynonyms
6tertbutyl2(((E)(4nitrothiophen2yl)methylidene)amino)4567tetrahydro1benzothiophene3carbonitrile
6tertbutyl2((E)(4nitrothiophen2yl)methylideneamino)4567tetrahydro1benzothiophene3carbonitrile
CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)N=CC3=CC(=CS3)(N+)(=O)(O)
InChI=1SC18H19N3O2S2c118(23)11451415(819)17(2516(14)611)20913712(102413)21(22)23h7911H46H213H3b209+
MFCD00822884
N#Cc1c(N=Cc2scc(c2)(N+)(=O)(O))sc2c1CCC(C2)C(C)(C)C
ZINC000000712689
ZINC000000712692
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