Vitas-M small molecule compound
4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-iodo-6-methoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK379035
SMILES COc1cc(/C=N/NC(=S)N)cc(c1OS(=O)(=O)c1ccc(cc1)C)I
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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 C16H16IN3O4S2 MW 505.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16IN3O4S2/c1-10-3-5-12(6-4-10)26(21,22)24-15-13(17)7-11(8-14(15)23-2)9-19-20-16(18)25/h3-9H,1-2H3,(H3,18,20,25)/b19-9+InChIKey
WDDXGOOHALKRLS-DJKKODMXSA-NSynonyms
(4((E)(carbamothioylhydrazinylidene)methyl)2iodo6methoxyphenyl)4methylbenzenesulfonate
4((1E)2((AMINOTHIOXOMETHYL)AMINO)2AZAVINYL)2IODO6METHOXYPHENYL4METHYLBENZENESULFONATE
4((E)(2carbamothioylhydrazinylidene)methyl)2iodo6methoxyphenyl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2I)C=NNC(=S)N)OC
COc1cc(C=NNC(=S)N)cc(c1OS(=O)(=O)c1ccc(cc1)C)I
InChI=1SC16H16IN3O4S2c1103512(6410)26(2122)241513(17)711(814(15)232)9192016(18)25h39H12H3(H3182025)b199+
MFCD02067511
ZINC000008843250
ZINC83316201
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