Vitas-M small molecule compound

diethyl (6E)-2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-{2-[(4-methylphenyl)sulfonyl]hydrazinylidene}cyclohexane-1,3-dicarboxylate

Catalog ID
STK693213
SMILES CCOC(=O)C1/C(=N/NS(=O)(=O)c2ccc(cc2)C)/CC(C(C1c1ccc(cc1)N(C)C)C(=O)OCC)(C)O

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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 C28H37N3O7S MW 559.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O7S/c1-7-37-26(32)24-22(29-30-39(35,36)21-15-9-18(3)10-16-21)17-28(4,34)25(27(33)38-8-2)23(24)19-11-13-20(14-12-19)31(5)6/h9-16,23-25,30,34H,7-8,17H2,1-6H3/b29-22+
InChIKey
LLYBBIGZKVTSAO-QUPMIFSKSA-N
Synonyms

CCOC(=O)C1C(=NNS(=O)(=O)c2ccc(cc2)C)CC(C(C1c1ccc(cc1)N(C)C)C(=O)OCC)(C)O
CCOC(=O)C1C(C(C(CC1=NNS(=O)(=O)C2=CC=C(C=C2)C)(C)O)C(=O)OCC)C3=CC=C(C=C3)N(C)C
diethyl(6E)2(4(dimethylamino)phenyl)4hydroxy4methyl6((4methylphenyl)sulfonylhydrazinylidene)cyclohexane13dicarboxylate
DIETHYL(6E)2(4(DIMETHYLAMINO)PHENYL)4HYDROXY4METHYL6(2((4METHYLPHENYL)SULFONYL)HYDRAZINYLIDENE)CYCLOHEXANE13DICARBOXYLATE
InChI=1SC28H37N3O7Sc173726(32)2422(293039(3536)2115918(3)101621)1728(434)25(27(33)3882)23(24)19111320(141219)31(5)6h91623253034H7817H216H3b2922+
MFCD10039304
ZINC000100239196
ZINC000230093235

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Available files

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