Vitas-M small molecule compound
N-{2-[(2-chlorobenzyl)sulfanyl]ethyl}-4-methyl-3-nitrobenzamide
Catalog ID
STK393771
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)NCCSCc1ccccc1Cl
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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/c1-12-6-7-13(10-16(12)20(22)23)17(21)19-8-9-24-11-14-4-2-3-5-15(14)18/h2-7,10H,8-9,11H2,1H3,(H,19,21)InChIKey
NWKQTBHHDXABIG-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2Cl)(N+)(=O)(O)
InChI=1SC17H17ClN2O3Sc1126713(1016(12)20(22)23)17(21)1989241114423515(14)18h2710H8911H21H3(H1921)
MFCD02807057
N(2((2chlorobenzyl)sulfanyl)ethyl)4methyl3nitrobenzamide
N(2((2CHLOROPHENYL)METHYLSULFANYL)ETHYL)4METHYL3NITROBENZAMIDE
N(2((2CHLOROPHENYL)METHYLTHIO)ETHYL)(4METHYL3NITROPHENYL)CARBOXAMIDE
O=C(c1ccc(c(c1)(N+)(=O)(O))C)NCCSCc1ccccc1Cl
ZINC000004520019
ZINC04520019
ZINC4520019
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