Vitas-M small molecule compound

methyl {4-[(E)-{2-[(2-{(4-chlorobenzyl)[(4-methylphenyl)sulfonyl]amino}phenyl)carbonyl]hydrazinylidene}methyl]phenoxy}acetate

Catalog ID
STL113111
SMILES COC(=O)COc1ccc(cc1)/C=N/NC(=O)c1ccccc1N(S(=O)(=O)c1ccc(cc1)C)Cc1ccc(cc1)Cl

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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 C31H28ClN3O6S MW 606.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O6S/c1-22-7-17-27(18-8-22)42(38,39)35(20-24-9-13-25(32)14-10-24)29-6-4-3-5-28(29)31(37)34-33-19-23-11-15-26(16-12-23)41-21-30(36)40-2/h3-19H,20-21H2,1-2H3,(H,34,37)/b33-19+
InChIKey
UOTHQDCDJZYYNG-HNSNBQBZSA-N
Synonyms

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Cl)C3=CC=CC=C3C(=O)NN=CC4=CC=C(C=C4)OCC(=O)OC
COC(=O)COc1ccc(cc1)C=NNC(=O)c1ccccc1N(S(=O)(=O)c1ccc(cc1)C)Cc1ccc(cc1)Cl
InChI=1SC31H28ClN3O6Sc12271727(18822)42(3839)35(202491325(32)141024)29643528(29)31(37)34331923111526(161223)412130(36)402h319H2021H212H3(H3437)b3319+
methyl(4((E)(2((2((4chlorobenzyl)((4methylphenyl)sulfonyl)amino)phenyl)carbonyl)hydrazinylidene)methyl)phenoxy)acetate
METHYL2(4((1E)2((2(((4CHLOROPHENYL)METHYL)((4METHYLPHENYL)SULFONYL)AMINO)PHENYL)CARBONYLAMINO)2AZAVINYL)PHENOXY)ACETATE
methyl2(4((E)((2((4chlorophenyl)methyl(4methylphenyl)sulfonylamino)benzoyl)hydrazinylidene)methyl)phenoxy)acetate
MFCD03550197
ZINC000059646914
ZINC103141993

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Available files

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