Vitas-M small molecule compound
N-[2-(cyclohexylsulfanyl)ethyl]-2-methyl-3-nitrobenzamide
Catalog ID
STL253656
SMILES O=C(c1cccc(c1C)[N+](=O)[O-])NCCSC1CCCCC1
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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 C16H22N2O3S MW 322.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O3S/c1-12-14(8-5-9-15(12)18(20)21)16(19)17-10-11-22-13-6-3-2-4-7-13/h5,8-9,13H,2-4,6-7,10-11H2,1H3,(H,17,19)InChIKey
DUAIIQNSADBVHT-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NCCSC2CCCCC2
InChI=1SC16H22N2O3Sc11214(85915(12)18(20)21)16(19)17101122136324713h58913H24671011H21H3(H1719)
MFCD03573515
N(2(cyclohexylsulfanyl)ethyl)2methyl3nitrobenzamide
N(2CYCLOHEXYLSULFANYLETHYL)2METHYL3NITROBENZAMIDE
O=C(c1cccc(c1C)(N+)(=O)(O))NCCSC1CCCCC1
ZINC000002816115
ZINC02816115
ZINC2816115
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