Vitas-M small molecule compound

N-(2-methoxy-5-methylphenyl)-4-methyl-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide

Catalog ID
STK916462
SMILES COc1ccc(cc1N(S(=O)(=O)c1ccc(cc1)C)CC(=O)N1CCN(CC1)c1ccccc1)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 C27H31N3O4S MW 493.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4S/c1-21-9-12-24(13-10-21)35(32,33)30(25-19-22(2)11-14-26(25)34-3)20-27(31)29-17-15-28(16-18-29)23-7-5-4-6-8-23/h4-14,19H,15-18,20H2,1-3H3
InChIKey
FNEMLZOCJBWHFP-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCN(CC2)C3=CC=CC=C3)C4=C(C=CC(=C4)C)OC
InChI=1SC27H31N3O4Sc12191224(131021)35(3233)30(251922(2)111426(25)343)2027(31)29171528(161829)237546823h41419H151820H213H3
MFCD03135309
N(2methoxy5methylphenyl)4methylN(2oxo2(4phenylpiperazin1yl)ethyl)benzenesulfonamide
ZINC000015822574
ZINC15822574

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Available files

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