Vitas-M small molecule compound

methyl 4-methyl-2-{(2E)-2-[4-(propan-2-yl)benzylidene]hydrazinyl}-1,3-thiazole-5-carboxylate

Catalog ID
STK810236
SMILES COC(=O)c1sc(nc1C)N/N=C/c1ccc(cc1)C(C)C

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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 C16H19N3O2S MW 317.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O2S/c1-10(2)13-7-5-12(6-8-13)9-17-19-16-18-11(3)14(22-16)15(20)21-4/h5-10H,1-4H3,(H,18,19)/b17-9+
InChIKey
FQUYYBAWMSLRFZ-RQZCQDPDSA-N
Synonyms

CC1=C(SC(=N1)NN=CC2=CC=C(C=C2)C(C)C)C(=O)OC
COC(=O)c1sc(nc1C)NN=Cc1ccc(cc1)C(C)C
InChI=1SC16H19N3O2Sc110(2)137512(6813)91719161811(3)14(2216)15(20)214h510H14H3(H1819)b179+
methyl4methyl2((2E)2((4propan2ylphenyl)methylidene)hydrazinyl)13thiazole5carboxylate
methyl4methyl2((2E)2(4(propan2yl)benzylidene)hydrazinyl)13thiazole5carboxylate
MFCD03462513
ZINC000006052776
ZINC38204078

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Available files

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