Vitas-M small molecule compound

methyl ({3-[(4-chlorophenyl)sulfonyl]-2-methyl-5-nitrophenyl}sulfanyl)acetate

Catalog ID
STK767216
SMILES COC(=O)CSc1cc(cc(c1C)S(=O)(=O)c1ccc(cc1)Cl)[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 C16H14ClNO6S2 MW 415.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO6S2/c1-10-14(25-9-16(19)24-2)7-12(18(20)21)8-15(10)26(22,23)13-5-3-11(17)4-6-13/h3-8H,9H2,1-2H3
InChIKey
OPIIMRKVXNXRSJ-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1S(=O)(=O)C2=CC=C(C=C2)Cl)(N+)(=O)(O))SCC(=O)OC
COC(=O)CSc1cc(cc(c1C)S(=O)(=O)c1ccc(cc1)Cl)(N+)(=O)(O)
InChI=1SC16H14ClNO6S2c11014(25916(19)242)712(18(20)21)815(10)26(2223)135311(17)4613h38H9H212H3
methyl((3((4chlorophenyl)sulfonyl)2methyl5nitrophenyl)sulfanyl)acetate
METHYL2(3((4CHLOROPHENYL)SULFONYL)2METHYL5NITROPHENYLTHIO)ACETATE
METHYL2(3(4CHLOROPHENYL)SULFONYL2METHYL5NITROPHENYL)SULFANYLACETATE
MFCD03034278
ZINC000001085878
ZINC01085878
ZINC1085878

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Available files

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