Vitas-M small molecule compound
(2Z)-2-[1-(4-bromo-5-nitrothiophen-2-yl)ethylidene]-N-phenylhydrazinecarbothioamide
Catalog ID
STL290401
SMILES S=C(Nc1ccccc1)N/N=C(\c1cc(c(s1)[N+](=O)[O-])Br)/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 C13H11BrN4O2S2 MW 399.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrN4O2S2/c1-8(11-7-10(14)12(22-11)18(19)20)16-17-13(21)15-9-5-3-2-4-6-9/h2-7H,1H3,(H2,15,17,21)/b16-8-InChIKey
RNRXFNAFRCAHQI-PXNMLYILSA-NSynonyms
(2Z)2(1(4bromo5nitrothiophen2yl)ethylidene)Nphenylhydrazinecarbothioamide
1((Z)1(4bromo5nitrothiophen2yl)ethylideneamino)3phenylthiourea
CC(=NNC(=S)NC1=CC=CC=C1)C2=CC(=C(S2)(N+)(=O)(O))Br
InChI=1SC13H11BrN4O2S2c18(11710(14)12(2211)18(19)20)161713(21)159532469h27H1H3(H2151721)b168
MFCD19703179
S=C(Nc1ccccc1)NN=C(c1cc(c(s1)(N+)(=O)(O))Br)C
ZINC000072433959
ZINC101347776
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