Vitas-M small molecule compound

N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(ethylsulfanyl)-N-(propan-2-yl)benzamide

Catalog ID
STK241857
SMILES CCSc1ccccc1C(=O)N(C(C)C)Cc1onc(n1)c1ccc(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 C21H22ClN3O2S MW 415.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O2S/c1-4-28-18-8-6-5-7-17(18)21(26)25(14(2)3)13-19-23-20(24-27-19)15-9-11-16(22)12-10-15/h5-12,14H,4,13H2,1-3H3
InChIKey
ROLVJPSKDPWLFK-UHFFFAOYSA-N
Synonyms

CCSC1=CC=CC=C1C(=O)N(CC2=NC(=NO2)C3=CC=C(C=C3)Cl)C(C)C
InChI=1SC21H22ClN3O2Sc142818865717(18)21(26)25(14(2)3)13192320(242719)1591116(22)121015h51214H413H213H3
MFCD08681301
N((3(4chlorophenyl)124oxadiazol5yl)methyl)2(ethylsulfanyl)N(propan2yl)benzamide
N((3(4CHLOROPHENYL)124OXADIAZOL5YL)METHYL)2ETHYLSULFANYLNPROPAN2YLBENZAMIDE
ZINC000007684458
ZINC07684458
ZINC7684458

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Available files

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