Vitas-M small molecule compound
5-(2-methoxyphenyl)-8,8-dimethyl-2-[(pyridin-2-ylmethyl)sulfanyl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STL193584
SMILES COc1ccccc1C1C2=C(Nc3c1c(=O)[nH]c(n3)SCc1ccccn1)CC(CC2=O)(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 C26H26N4O3S MW 474.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3S/c1-26(2)12-17-21(18(31)13-26)20(16-9-4-5-10-19(16)33-3)22-23(28-17)29-25(30-24(22)32)34-14-15-8-6-7-11-27-15/h4-11,20H,12-14H2,1-3H3,(H2,28,29,30,32)InChIKey
ZUDCURMRCCNUPV-UHFFFAOYSA-NSynonyms
5(2methoxyphenyl)88dimethyl2((pyridin2ylmethyl)sulfanyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
5(2methoxyphenyl)88dimethyl2(pyridin2ylmethylsulfanyl)57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC1(CC2=C(C(C3=C(N2)NC(=NC3=O)SCC4=CC=CC=N4)C5=CC=CC=C5OC)C(=O)C1)C
COc1ccccc1C1C2=C(Nc3c1c(=O)(nH)c(n3)SCc1ccccn1)CC(CC2=O)(C)C
InChI=1SC26H26N4O3Sc126(2)121721(18(31)1326)20(169451019(16)333)2223(2817)2925(3024(22)32)341415867112715h41120H1214H213H3(H228293032)
MFCD14730454
ZINC000004787163
ZINC000004787170
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