Vitas-M small molecule compound

methyl 4-({2-[(E)-(2-carbamothioylhydrazinylidene)methyl]phenoxy}methyl)benzoate

Catalog ID
STK709491
SMILES COC(=O)c1ccc(cc1)COc1ccccc1/C=N/NC(=S)N

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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 C17H17N3O3S MW 343.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O3S/c1-22-16(21)13-8-6-12(7-9-13)11-23-15-5-3-2-4-14(15)10-19-20-17(18)24/h2-10H,11H2,1H3,(H3,18,20,24)/b19-10+
InChIKey
HMXKOQKJSQLUDO-VXLYETTFSA-N
Synonyms
387847-46-3
(E)methyl4((2((2carbamothioylhydrazono)methyl)phenoxy)methyl)benzoate
387847463
COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=NNC(=S)N
COC(=O)c1ccc(cc1)COc1ccccc1C=NNC(=S)N
InChI=1SC17H17N3O3Sc12216(21)138612(7913)112315532414(15)10192017(18)24h210H11H21H3(H3182024)b1910+
methyl4((2((E)(2carbamothioylhydrazinylidene)methyl)phenoxy)methyl)benzoate
methyl4((2((E)(carbamothioylhydrazinylidene)methyl)phenoxy)methyl)benzoate
MFCD01582806
ZINC000000546976
ZINC33324279

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Available files

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