Vitas-M small molecule compound
4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl 4-fluorobenzoate
Catalog ID
STK033521
SMILES COc1cc(/C=N/NC(=S)N)ccc1OC(=O)c1ccc(cc1)F
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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 C16H14FN3O3S MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14FN3O3S/c1-22-14-8-10(9-19-20-16(18)24)2-7-13(14)23-15(21)11-3-5-12(17)6-4-11/h2-9H,1H3,(H3,18,20,24)/b19-9+InChIKey
MLZGKGOPQINOFK-DJKKODMXSA-NSynonyms
(4((E)(carbamothioylhydrazinylidene)methyl)2methoxyphenyl)4fluorobenzoate
4((1E)2((AMINOTHIOXOMETHYL)AMINO)2AZAVINYL)2METHOXYPHENYL4FLUOROBENZOATE
4((E)(2CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)2METHOXYPHENYL4FLUOROBENZOATE
COC1=C(C=CC(=C1)C=NNC(=S)N)OC(=O)C2=CC=C(C=C2)F
COc1cc(C=NNC(=S)N)ccc1OC(=O)c1ccc(cc1)F
InChI=1SC16H14FN3O3Sc12214810(9192016(18)24)2713(14)2315(21)113512(17)6411h29H1H3(H3182024)b199+
MFCD02124136
STK033521
ZINC000004510943
ZINC33923422
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