Vitas-M small molecule compound
4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl 3-fluorobenzoate
Catalog ID
STK899399
SMILES COc1cc(/C=N/NC(=S)N)ccc1OC(=O)c1cccc(c1)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/c1-22-14-7-10(9-19-20-16(18)24)5-6-13(14)23-15(21)11-3-2-4-12(17)8-11/h2-9H,1H3,(H3,18,20,24)/b19-9+InChIKey
RSHNEYBTHIOKJQ-DJKKODMXSA-NSynonyms
494757-34-5(4((E)(carbamothioylhydrazinylidene)methyl)2methoxyphenyl)3fluorobenzoate
4((E)(2carbamothioylhydrazinylidene)methyl)2methoxyphenyl3fluorobenzoate
494757345
COC1=C(C=CC(=C1)C=NNC(=S)N)OC(=O)C2=CC(=CC=C2)F
COc1cc(C=NNC(=S)N)ccc1OC(=O)c1cccc(c1)F
InChI=1SC16H14FN3O3Sc12214710(9192016(18)24)5613(14)2315(21)1132412(17)811h29H1H3(H3182024)b199+
MFCD02604774
ZINC000000979578
ZINC33286614
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