Vitas-M small molecule compound
{2-[2,4,6-trioxo-8-(thiophen-2-yl)-1,2,3,4,5,6,7,8,9,10-decahydropyrimido[4,5-b]quinolin-5-yl]phenoxy}acetic acid
Catalog ID
STK335960
SMILES OC(=O)COc1ccccc1C1C2=C(CC(CC2=O)c2cccs2)Nc2c1c(=O)[nH]c(=O)[nH]2
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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 C23H19N3O6S MW 465.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O6S/c27-14-9-11(16-6-3-7-33-16)8-13-19(14)18(20-21(24-13)25-23(31)26-22(20)30)12-4-1-2-5-15(12)32-10-17(28)29/h1-7,11,18H,8-10H2,(H,28,29)(H3,24,25,26,30,31)InChIKey
NOASNDMUNGGIHE-UHFFFAOYSA-NSynonyms
(2(246trioxo8(thiophen2yl)12345678910decahydropyrimido(45b)quinolin5yl)phenoxy)aceticacid
2(2(246trioxo8thiophen2yl1578910hexahydropyrimido(45b)quinolin5yl)phenoxy)aceticacid
C1C(CC(=O)C2=C1NC3=C(C2C4=CC=CC=C4OCC(=O)O)C(=O)NC(=O)N3)C5=CC=CS5
InChI=1SC23H19N3O6Sc2714911(166373316)81319(14)18(2021(2413)2523(31)2622(20)30)12412515(12)321017(28)29h171118H810H2(H2829)(H32425263031)
MFCD09964388
OC(=O)COc1ccccc1C1C2=C(CC(CC2=O)c2cccs2)Nc2c1c(=O)(nH)c(=O)(nH)2
ZINC000018200575
ZINC000018200580
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