Vitas-M small molecule compound

N-butyl-3-(2-{[2-(2-chlorophenyl)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide

Catalog ID
STL074176
SMILES CCCCNC(=O)c1cccc(c1)n1ccnc1SCC(=O)c1ccccc1Cl

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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 C22H22ClN3O2S MW 427.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O2S/c1-2-3-11-24-21(28)16-7-6-8-17(14-16)26-13-12-25-22(26)29-15-20(27)18-9-4-5-10-19(18)23/h4-10,12-14H,2-3,11,15H2,1H3,(H,24,28)
InChIKey
RTMPJHZOFBTMOJ-UHFFFAOYSA-N
Synonyms

CCCCNC(=O)C1=CC(=CC=C1)N2C=CN=C2SCC(=O)C3=CC=CC=C3Cl
InChI=1SC22H22ClN3O2Sc123112421(28)1676817(1416)2613122522(26)291520(27)189451019(18)23h4101214H231115H21H3(H2428)
MFCD18195570
Nbutyl3(2((2(2chlorophenyl)2oxoethyl)sulfanyl)1Himidazol1yl)benzamide
Nbutyl3(2(2(2chlorophenyl)2oxoethyl)sulfanylimidazol1yl)benzamide
ZINC000057486300
ZINC57486300

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Available files

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