Vitas-M small molecule compound
N-[2-(benzylsulfanyl)ethyl]-4-methyl-3-nitrobenzamide
Catalog ID
STL137142
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)NCCSCc1ccccc1
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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 C17H18N2O3S MW 330.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O3S/c1-13-7-8-15(11-16(13)19(21)22)17(20)18-9-10-23-12-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,18,20)InChIKey
YKMVAGDTRRIWPF-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2)(N+)(=O)(O)
InChI=1SC17H18N2O3Sc1137815(1116(13)19(21)22)17(20)189102312145324614h2811H91012H21H3(H1820)
MFCD03559782
N(2(benzylsulfanyl)ethyl)4methyl3nitrobenzamide
N(2(BENZYLTHIO)ETHYL)4METHYL3NITROBENZAMIDE
N(2BENZYLSULFANYLETHYL)4METHYL3NITROBENZAMIDE
O=C(c1ccc(c(c1)(N+)(=O)(O))C)NCCSCc1ccccc1
ZINC000002983952
ZINC02983952
ZINC2983952
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