Vitas-M small molecule compound
4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-ethoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK379034
SMILES CCOc1cc(/C=N/NC(=S)N)ccc1OS(=O)(=O)c1ccc(cc1)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 C17H19N3O4S2 MW 393.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O4S2/c1-3-23-16-10-13(11-19-20-17(18)25)6-9-15(16)24-26(21,22)14-7-4-12(2)5-8-14/h4-11H,3H2,1-2H3,(H3,18,20,25)/b19-11+InChIKey
AYNSALHPRBRZTQ-YBFXNURJSA-NSynonyms
(4((E)(carbamothioylhydrazinylidene)methyl)2ethoxyphenyl)4methylbenzenesulfonate
4((1E)2((AMINOTHIOXOMETHYL)AMINO)2AZAVINYL)2ETHOXYPHENYL4METHYLBENZENESULFONATE
4((E)(2carbamothioylhydrazinylidene)methyl)2ethoxyphenyl4methylbenzenesulfonate
CCOC1=C(C=CC(=C1)C=NNC(=S)N)OS(=O)(=O)C2=CC=C(C=C2)C
CCOc1cc(C=NNC(=S)N)ccc1OS(=O)(=O)c1ccc(cc1)C
InChI=1SC17H19N3O4S2c1323161013(11192017(18)25)6915(16)2426(2122)147412(2)5814h411H3H212H3(H3182025)b1911+
MFCD01874493
ZINC000004503266
ZINC33662124
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