Vitas-M small molecule compound
6-methyl-2-{[(E)-(4-nitrothiophen-2-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK753247
SMILES N#Cc1c(/N=C/c2scc(c2)[N+](=O)[O-])sc2c1CCC(C2)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 C15H13N3O2S2 MW 331.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O2S2/c1-9-2-3-12-13(6-16)15(22-14(12)4-9)17-7-11-5-10(8-21-11)18(19)20/h5,7-9H,2-4H2,1H3/b17-7+InChIKey
DTLUXXAFUHHKCY-REZTVBANSA-NSynonyms
6methyl2(((E)(4nitrothiophen2yl)methylidene)amino)4567tetrahydro1benzothiophene3carbonitrile
6methyl2((E)(4nitrothiophen2yl)methylideneamino)4567tetrahydro1benzothiophene3carbonitrile
CC1CCC2=C(C1)SC(=C2C#N)N=CC3=CC(=CS3)(N+)(=O)(O)
InChI=1SC15H13N3O2S2c19231213(616)15(2214(12)49)17711510(82111)18(19)20h579H24H21H3b177+
MFCD00823014
N#Cc1c(N=Cc2scc(c2)(N+)(=O)(O))sc2c1CCC(C2)C
ZINC000000062024
ZINC000000062026
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