Vitas-M small molecule compound

ethyl 4-{[(2-{[(2-chloro-4-fluorobenzyl)sulfanyl]acetyl}hydrazinyl)carbonothioyl]amino}benzoate

Catalog ID
STK445666
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NNC(=O)CSCc1ccc(cc1Cl)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 C19H19ClFN3O3S2 MW 455.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClFN3O3S2/c1-2-27-18(26)12-4-7-15(8-5-12)22-19(28)24-23-17(25)11-29-10-13-3-6-14(21)9-16(13)20/h3-9H,2,10-11H2,1H3,(H,23,25)(H2,22,24,28)
InChIKey
AHNQINORPBHZTL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC(=O)CSCC2=C(C=C(C=C2)F)Cl
ETHYL4((((2((2CHLORO4FLUOROPHENYL)METHYLTHIO)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)BENZOATE
ethyl4(((2(((2chloro4fluorobenzyl)sulfanyl)acetyl)hydrazinyl)carbonothioyl)amino)benzoate
ethyl4(((2((2chloro4fluorophenyl)methylsulfanyl)acetyl)amino)carbamothioylamino)benzoate
InChI=1SC19H19ClFN3O3S2c122718(26)124715(8512)2219(28)242317(25)112910133614(21)916(13)20h39H21011H21H3(H2325)(H2222428)
MFCD04057705
ZINC000020168990
ZINC20168990

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Available files

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