Vitas-M small molecule compound

ethyl 3-{[(2-nitrophenyl)sulfanyl]amino}benzoate

Catalog ID
STK857957
SMILES CCOC(=O)c1cccc(c1)NSc1ccccc1[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 C15H14N2O4S MW 318.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O4S/c1-2-21-15(18)11-6-5-7-12(10-11)16-22-14-9-4-3-8-13(14)17(19)20/h3-10,16H,2H2,1H3
InChIKey
AEDCWMBLPIGNSV-UHFFFAOYSA-N
Synonyms
301689-78-1
301689781
CCOC(=O)C1=CC(=CC=C1)NSC2=CC=CC=C2(N+)(=O)(O)
CCOC(=O)c1cccc(c1)NSc1ccccc1(N+)(=O)(O)
ethyl3(((2nitrophenyl)sulfanyl)amino)benzoate
ethyl3(((2nitrophenyl)thio)amino)benzoate
ETHYL3((2NITROPHENYL)SULFANYLAMINO)BENZOATE
ETHYL3((2NITROPHENYLTHIO)AMINO)BENZOATE
InChI=1SC15H14N2O4Sc122115(18)1165712(1011)162214943813(14)17(19)20h31016H2H21H3
MFCD01910593
ZINC000003958931
ZINC03958931
ZINC3958931

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.