Vitas-M small molecule compound
2-[(3-fluorobenzyl)sulfanyl]-5-(4-fluorophenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK914459
SMILES Fc1ccc(cc1)C1C2=C(Nc3c1c(=O)[nH]c(n3)SCc1cccc(c1)F)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 C26H23F2N3O2S MW 479.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23F2N3O2S/c1-26(2)11-18-21(19(32)12-26)20(15-6-8-16(27)9-7-15)22-23(29-18)30-25(31-24(22)33)34-13-14-4-3-5-17(28)10-14/h3-10,20H,11-13H2,1-2H3,(H2,29,30,31,33)InChIKey
GBKPSZPAJMBGGK-UHFFFAOYSA-NSynonyms
2((3fluorobenzyl)sulfanyl)5(4fluorophenyl)88dimethyl58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
5(4fluorophenyl)2((3fluorophenyl)methylsulfanyl)88dimethyl57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC1(CC2=C(C(C3=C(N2)NC(=NC3=O)SCC4=CC(=CC=C4)F)C5=CC=C(C=C5)F)C(=O)C1)C
Fc1ccc(cc1)C1C2=C(Nc3c1c(=O)(nH)c(n3)SCc1cccc(c1)F)CC(CC2=O)(C)C
InChI=1SC26H23F2N3O2Sc126(2)111821(19(32)1226)20(156816(27)9715)2223(2918)3025(3124(22)33)34131443517(28)1014h31020H1113H212H3(H229303133)
MFCD14748289
ZINC000009608856
ZINC000009608859
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