Vitas-M small molecule compound
4-chloro-N-{2-[(3-methylbenzyl)sulfanyl]ethyl}-3-nitrobenzamide
Catalog ID
STL259378
SMILES Cc1cccc(c1)CSCCNC(=O)c1ccc(c(c1)[N+](=O)[O-])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 C17H17ClN2O3S MW 364.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN2O3S/c1-12-3-2-4-13(9-12)11-24-8-7-19-17(21)14-5-6-15(18)16(10-14)20(22)23/h2-6,9-10H,7-8,11H2,1H3,(H,19,21)InChIKey
JNPBMLGKRGNZOJ-UHFFFAOYSA-NSynonyms
4chloroN(2((3methylbenzyl)sulfanyl)ethyl)3nitrobenzamide
4CHLORON(2((3METHYLPHENYL)METHYLSULFANYL)ETHYL)3NITROBENZAMIDE
CC1=CC(=CC=C1)CSCCNC(=O)C2=CC(=C(C=C2)Cl)(N+)(=O)(O)
Cc1cccc(c1)CSCCNC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC17H17ClN2O3Sc11232413(912)1124871917(21)145615(18)16(1014)20(22)23h26910H7811H21H3(H1921)
MFCD03706379
ZINC000002989899
ZINC02989899
ZINC2989899
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