Vitas-M small molecule compound
3-butyl-2-methyl-4-thioxo-1,4-dihydroquinoline-6-carboxylic acid
Catalog ID
STK559557
SMILES Cc1c(CCCC)c(=S)c2c([nH]1)ccc(c2)C(=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 C15H17NO2S MW 275.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO2S/c1-3-4-5-11-9(2)16-13-7-6-10(15(17)18)8-12(13)14(11)19/h6-8H,3-5H2,1-2H3,(H,16,19)(H,17,18)InChIKey
GEYQTLLBJRTPNV-UHFFFAOYSA-NSynonyms
419553-62-13BUTYL2METHYL4SULFANYLIDENE1HQUINOLINE6CARBOXYLICACID
3butyl2methyl4thioxo14dihydroquinoline6carboxylicacid
419553621
Cc1c(CCCC)c(=S)c2c((nH)1)ccc(c2)C(=O)O
CCCCC1=C(NC2=C(C1=S)C=C(C=C2)C(=O)O)C
InChI=1SC15H17NO2Sc1345119(2)16137610(15(17)18)812(13)14(11)19h68H35H212H3(H1619)(H1718)
MFCD03812372
ZINC000002591753
ZINC2591753
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