Vitas-M small molecule compound
[(6-nitro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)sulfanyl]acetic acid
Catalog ID
STK091847
SMILES OC(=O)CSc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)[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 C17H12N2O5S MW 356.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O5S/c20-14(21)9-25-16-15(10-4-2-1-3-5-10)12-8-11(19(23)24)6-7-13(12)18-17(16)22/h1-8H,9H2,(H,18,22)(H,20,21)InChIKey
CQBJWXJQRHHGET-UHFFFAOYSA-NSynonyms
((6NITRO2OXO4PHENYL12DIHYDROQUINOLIN3YL)SULFANYL)ACETICACID
2((6NITRO2OXO4PHENYL1HQUINOLIN3YL)SULFANYL)ACETICACID
2(6NITRO2OXO4PHENYL3HYDROQUINOLYLTHIO)ACETICACID
C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)(N+)(=O)(O))SCC(=O)O
InChI=1SC17H12N2O5Sc2014(21)9251615(104213510)12811(19(23)24)6713(12)1817(16)22h18H9H2(H1822)(H2021)
MFCD03488792
OC(=O)CSc1c(=O)(nH)c2c(c1c1ccccc1)cc(cc2)(N+)(=O)(O)
STK091847
ZINC000004619185
ZINC4619185
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