Vitas-M small molecule compound
4-amino-5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2-(propylsulfanyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinolin-6(7H)-one
Catalog ID
STK980868
SMILES CCCSc1nc(N)c2c(n1)NC1=C(C2c2ccc3c(c2)OCO3)C(=O)CC(C1)(C)C
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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 C23H26N4O3S MW 438.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O3S/c1-4-7-31-22-26-20(24)19-17(12-5-6-15-16(8-12)30-11-29-15)18-13(25-21(19)27-22)9-23(2,3)10-14(18)28/h5-6,8,17H,4,7,9-11H2,1-3H3,(H3,24,25,26,27)InChIKey
SGGNURWUNXJKKG-UHFFFAOYSA-NSynonyms
4amino5(13benzodioxol5yl)88dimethyl2(propylsulfanyl)58910tetrahydropyrimido(45b)quinolin6(7H)one
4amino5(13benzodioxol5yl)88dimethyl2propylsulfanyl57910tetrahydropyrimido(45b)quinolin6one
CCCSC1=NC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC5=C(C=C4)OCO5)C(=N1)N
InChI=1SC23H26N4O3Sc14731222620(24)1917(12561516(812)30112915)1813(2521(19)2722)923(23)1014(18)28h56817H47911H213H3(H324252627)
MFCD18181230
ZINC000044973517
ZINC000044973521
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