Vitas-M small molecule compound

4-{(E)-[2-({2-[benzyl(methylsulfonyl)amino]phenyl}carbonyl)hydrazinylidene]methyl}phenyl benzoate

Catalog ID
STL136389
SMILES O=C(c1ccccc1)Oc1ccc(cc1)/C=N/NC(=O)c1ccccc1N(S(=O)(=O)C)Cc1ccccc1

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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 C29H25N3O5S MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O5S/c1-38(35,36)32(21-23-10-4-2-5-11-23)27-15-9-8-14-26(27)28(33)31-30-20-22-16-18-25(19-17-22)37-29(34)24-12-6-3-7-13-24/h2-20H,21H2,1H3,(H,31,33)/b30-20+
InChIKey
HVKMOJNORUJUOF-TWKHWXDSSA-N
Synonyms

(4((E)((2(benzyl(methylsulfonyl)amino)benzoyl)hydrazinylidene)methyl)phenyl)benzoate
4((E)(2((2(benzyl(methylsulfonyl)amino)phenyl)carbonyl)hydrazinylidene)methyl)phenylbenzoate
CS(=O)(=O)N(CC1=CC=CC=C1)C2=CC=CC=C2C(=O)NN=CC3=CC=C(C=C3)OC(=O)C4=CC=CC=C4
InChI=1SC29H25N3O5Sc138(3536)32(2123104251123)2715981426(27)28(33)31302022161825(191722)3729(34)24126371324h220H21H21H3(H3133)b3020+
MFCD04082218
O=C(c1ccccc1)Oc1ccc(cc1)C=NNC(=O)c1ccccc1N(S(=O)(=O)C)Cc1ccccc1
ZINC000059646519
ZINC100935697

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Available files

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