Vitas-M small molecule compound

{[2-({3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethyl]sulfanyl}acetic acid

Catalog ID
STK302102
SMILES OCC(CSc1cc(NC(=O)CSCC(=O)O)cc(c1)[N+](=O)[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 C13H16N2O7S2 MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O7S2/c16-4-10(17)5-24-11-2-8(1-9(3-11)15(21)22)14-12(18)6-23-7-13(19)20/h1-3,10,16-17H,4-7H2,(H,14,18)(H,19,20)
InChIKey
DNLJOZRXEADLHG-UHFFFAOYSA-N
Synonyms
438230-70-7
((2((3((23dihydroxypropyl)sulfanyl)5nitrophenyl)amino)2oxoethyl)sulfanyl)aceticacid
2(2(3(23DIHYDROXYPROPYLSULFANYL)5NITROANILINO)2OXOETHYL)SULFANYLACETICACID
438230707
C1=C(C=C(C=C1(N+)(=O)(O))SCC(CO)O)NC(=O)CSCC(=O)O
InChI=1SC13H16N2O7S2c16410(17)5241128(19(311)15(21)22)1412(18)623713(19)20h13101617H47H2(H1418)(H1920)
MFCD03467059
OCC(CSc1cc(NC(=O)CSCC(=O)O)cc(c1)(N+)(=O)(O))O
ZINC000002764957
ZINC000002764958

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Available files

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