Vitas-M small molecule compound

6-{[(2-nitrophenyl)sulfanyl]amino}hexanoic acid

Catalog ID
STK369630
SMILES OC(=O)CCCCCNSc1ccccc1[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 C12H16N2O4S MW 284.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N2O4S/c15-12(16)8-2-1-5-9-13-19-11-7-4-3-6-10(11)14(17)18/h3-4,6-7,13H,1-2,5,8-9H2,(H,15,16)
InChIKey
XZSGFKWINTYSLZ-UHFFFAOYSA-N
Synonyms
52208-12-5
52208125
6(((2nitrophenyl)sulfanyl)amino)hexanoicacid
6((2NITROPHENYL)SULFANYLAMINO)HEXANOICACID
6((2NITROPHENYLTHIO)AMINO)HEXANOICACID
6(2NITROPHENYLTHIOAMINO)HEXANOICACID
C1=CC=C(C(=C1)(N+)(=O)(O))SNCCCCCC(=O)O
HEXANOICACID6(((2NITROPHENYL)THIO)AMINO)
InChI=1SC12H16N2O4Sc1512(16)82159131911743610(11)14(17)18h346713H12589H2(H1516)
MFCD00432863
OC(=O)CCCCCNSc1ccccc1(N+)(=O)(O)
ZINC000001786716
ZINC1786716

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Available files

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