Vitas-M small molecule compound
2-[(2-fluorobenzyl)sulfanyl]-8,8-dimethyl-5-(3-methylphenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK980820
SMILES Cc1cccc(c1)C1C2=C(Nc3c1c(=O)[nH]c(n3)SCc1ccccc1F)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 C27H26FN3O2S MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26FN3O2S/c1-15-7-6-9-16(11-15)21-22-19(12-27(2,3)13-20(22)32)29-24-23(21)25(33)31-26(30-24)34-14-17-8-4-5-10-18(17)28/h4-11,21H,12-14H2,1-3H3,(H2,29,30,31,33)InChIKey
KFXBVQBCCBLIOY-UHFFFAOYSA-NSynonyms
2((2fluorobenzyl)sulfanyl)88dimethyl5(3methylphenyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2((2fluorophenyl)methylsulfanyl)88dimethyl5(3methylphenyl)57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC1=CC=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=C2C(=O)N=C(N4)SCC5=CC=CC=C5F
Cc1cccc(c1)C1C2=C(Nc3c1c(=O)(nH)c(n3)SCc1ccccc1F)CC(CC2=O)(C)C
InChI=1SC27H26FN3O2Sc11576916(1115)212219(1227(23)1320(22)32)292423(21)25(33)3126(3024)3414178451018(17)28h41121H1214H213H3(H229303133)
MFCD03861330
ZINC000000702472
ZINC000000702473
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