Vitas-M small molecule compound
2-(benzylsulfanyl)-N-(2-methoxy-5-nitrophenyl)acetamide
Catalog ID
STK299628
SMILES COc1ccc(cc1NC(=O)CSCc1ccccc1)[N+](=O)[O-]
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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 C16H16N2O4S MW 332.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4S/c1-22-15-8-7-13(18(20)21)9-14(15)17-16(19)11-23-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,17,19)InChIKey
BXSIZDIZZBPFDQ-UHFFFAOYSA-NSynonyms
599159-55-42(benzylsulfanyl)N(2methoxy5nitrophenyl)acetamide
2(BENZYLTHIO)N(2METHOXY5NITROPHENYL)ACETAMIDE
2BENZYLSULFANYLN(2METHOXY5NITROPHENYL)ACETAMIDE
599159554
COC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)CSCC2=CC=CC=C2
COc1ccc(cc1NC(=O)CSCc1ccccc1)(N+)(=O)(O)
InChI=1SC16H16N2O4Sc122158713(18(20)21)914(15)1716(19)112310125324612h29H1011H21H3(H1719)
MFCD01974224
ZINC000000452790
ZINC00452790
ZINC452790
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