Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-5-(3-hydroxyphenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK980835
SMILES Oc1cccc(c1)C1C2=C(Nc3c1c(=O)[nH]c(n3)SCc1ccccc1Cl)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 C26H24ClN3O3S MW 494.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O3S/c1-26(2)11-18-21(19(32)12-26)20(14-7-5-8-16(31)10-14)22-23(28-18)29-25(30-24(22)33)34-13-15-6-3-4-9-17(15)27/h3-10,20,31H,11-13H2,1-2H3,(H2,28,29,30,33)InChIKey
FEYJTXMGRYBMDM-UHFFFAOYSA-NSynonyms
2((2chlorobenzyl)sulfanyl)5(3hydroxyphenyl)88dimethyl58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2((2chlorophenyl)methylsulfanyl)5(3hydroxyphenyl)88dimethyl57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC1(CC2=C(C(C3=C(N2)NC(=NC3=O)SCC4=CC=CC=C4Cl)C5=CC(=CC=C5)O)C(=O)C1)C
InChI=1SC26H24ClN3O3Sc126(2)111821(19(32)1226)20(1475816(31)1014)2223(2818)2925(3024(22)33)341315634917(15)27h3102031H1113H212H3(H228293033)
MFCD04457402
Oc1cccc(c1)C1C2=C(Nc3c1c(=O)(nH)c(n3)SCc1ccccc1Cl)CC(CC2=O)(C)C
ZINC000017242419
ZINC000017242426
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