Vitas-M small molecule compound
4-(dodecylsulfanyl)-3-nitrobenzonitrile
Catalog ID
STK408811
SMILES CCCCCCCCCCCCSc1ccc(cc1[N+](=O)[O-])C#N
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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 C19H28N2O2S MW 348.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2O2S/c1-2-3-4-5-6-7-8-9-10-11-14-24-19-13-12-17(16-20)15-18(19)21(22)23/h12-13,15H,2-11,14H2,1H3InChIKey
GDZHEGWOXUHGCB-UHFFFAOYSA-NSynonyms
3NITRO4(DODECYLTHIO)BENZONITRILE
4(dodecylsulfanyl)3nitrobenzonitrile
4DODECYLSULFANYL3NITROBENZONITRILE
CCCCCCCCCCCCSC1=C(C=C(C=C1)C#N)(N+)(=O)(O)
CCCCCCCCCCCCSc1ccc(cc1(N+)(=O)(O))C#N
InChI=1SC19H28N2O2Sc1234567891011142419131217(1620)1518(19)21(22)23h121315H21114H21H3
MFCD00183093
ZINC000101014854
ZINC101014854
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