Vitas-M small molecule compound

methyl 4-[(E)-(2-{[(4-chlorobenzyl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoate

Catalog ID
STK698617
SMILES COC(=O)c1ccc(cc1)/C=N/NC(=O)CSCc1ccc(cc1)Cl

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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 C18H17ClN2O3S MW 376.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2O3S/c1-24-18(23)15-6-2-13(3-7-15)10-20-21-17(22)12-25-11-14-4-8-16(19)9-5-14/h2-10H,11-12H2,1H3,(H,21,22)/b20-10+
InChIKey
JMMFEAKYUXFRTK-KEBDBYFISA-N
Synonyms

COC(=O)C1=CC=C(C=C1)C=NNC(=O)CSCC2=CC=C(C=C2)Cl
COC(=O)c1ccc(cc1)C=NNC(=O)CSCc1ccc(cc1)Cl
InChI=1SC18H17ClN2O3Sc12418(23)156213(3715)10202117(22)122511144816(19)9514h210H1112H21H3(H2122)b2010+
methyl4((E)((2((4chlorophenyl)methylsulfanyl)acetyl)hydrazinylidene)methyl)benzoate
methyl4((E)(2(((4chlorobenzyl)sulfanyl)acetyl)hydrazinylidene)methyl)benzoate
MFCD00494500
ZINC000001083731
ZINC33301449

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.