Vitas-M small molecule compound

N-(2,5-dimethylphenyl)-N-{2-[(2E)-2-(4-methyl-4-phenylpentan-2-ylidene)hydrazinyl]-2-oxoethyl}methanesulfonamide (non-preferred name)

Catalog ID
STL136839
SMILES O=C(CN(S(=O)(=O)C)c1cc(C)ccc1C)N/N=C(/CC(c1ccccc1)(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 C23H31N3O3S MW 429.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O3S/c1-17-12-13-18(2)21(14-17)26(30(6,28)29)16-22(27)25-24-19(3)15-23(4,5)20-10-8-7-9-11-20/h7-14H,15-16H2,1-6H3,(H,25,27)/b24-19+
InChIKey
LSRSWPOHNLNWOA-LYBHJNIJSA-N
Synonyms

2(25dimethylNmethylsulfonylanilino)N((E)(4methyl4phenylpentan2ylidene)amino)acetamide
CC1=CC(=C(C=C1)C)N(CC(=O)NN=C(C)CC(C)(C)C2=CC=CC=C2)S(=O)(=O)C
InChI=1SC23H31N3O3Sc117121318(2)21(1417)26(30(628)29)1622(27)252419(3)1523(45)20108791120h714H1516H216H3(H2527)b2419+
MFCD03014332
N((1E)24DIMETHYL4PHENYL1AZAPENT1ENYL)2((25DIMETHYLPHENYL)(METHYLSULFONYL)AMINO)ACETAMIDE
N(25dimethylphenyl)N(2((2E)2(4methyl4phenylpentan2ylidene)hydrazinyl)2oxoethyl)methanesulfonamide(nonpreferredname)
O=C(CN(S(=O)(=O)C)c1cc(C)ccc1C)NN=C(CC(c1ccccc1)(C)C)C
ZINC000005793645
ZINC33558309

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Available files

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