Vitas-M small molecule compound

methyl 3-{5-[(E)-(2-{3-methyl-2-[(thiophen-2-ylacetyl)amino]butanoyl}hydrazinylidene)methyl]furan-2-yl}benzoate (non-preferred name)

Catalog ID
STL381966
SMILES COC(=O)c1cccc(c1)c1ccc(o1)/C=N/NC(=O)C(C(C)C)NC(=O)Cc1cccs1

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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 C24H25N3O5S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O5S/c1-15(2)22(26-21(28)13-19-8-5-11-33-19)23(29)27-25-14-18-9-10-20(32-18)16-6-4-7-17(12-16)24(30)31-3/h4-12,14-15,22H,13H2,1-3H3,(H,26,28)(H,27,29)/b25-14+
InChIKey
NXPJSLIOHFBCTA-AFUMVMLFSA-N
Synonyms

CC(C)C(C(=O)NN=CC1=CC=C(O1)C2=CC(=CC=C2)C(=O)OC)NC(=O)CC3=CC=CS3
COC(=O)c1cccc(c1)c1ccc(o1)C=NNC(=O)C(C(C)C)NC(=O)Cc1cccs1
InChI=1SC24H25N3O5Sc115(2)22(2621(28)131985113319)23(29)2725141891020(3218)1664717(1216)24(30)313h412141522H13H213H3(H2628)(H2729)b2514+
methyl3(5((E)((3methyl2((2thiophen2ylacetyl)amino)butanoyl)hydrazinylidene)methyl)furan2yl)benzoate
methyl3(5((E)(2(3methyl2((thiophen2ylacetyl)amino)butanoyl)hydrazinylidene)methyl)furan2yl)benzoate(nonpreferredname)
MFCD04276476
ZINC000003764536
ZINC000003764538

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Available files

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