Vitas-M small molecule compound

N-(3-chloro-4-methylphenyl)-N-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}methanesulfonamide

Catalog ID
STK098894
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1ccc(c(c1)Cl)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 C21H26ClN3O4S MW 451.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClN3O4S/c1-16-4-5-18(14-20(16)22)25(30(3,27)28)15-21(26)24-12-10-23(11-13-24)17-6-8-19(29-2)9-7-17/h4-9,14H,10-13,15H2,1-3H3
InChIKey
PTSOAYNFPYLFFG-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)N(CC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)S(=O)(=O)C)Cl
COc1ccc(cc1)N1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1ccc(c(c1)Cl)C
InChI=1SC21H26ClN3O4Sc1164518(1420(16)22)25(30(327)28)1521(26)24121023(111324)176819(292)9717h4914H101315H213H3
MFCD03068385
N(3CHLORO4METHYLPHENYL)N(2(4(4METHOXYPHENYL)PIPERAZIN1YL)2OXOETHYL)METHANESULFONAMIDE
STK098894
ZINC000002993058
ZINC02993058
ZINC2993058

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Available files

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