Vitas-M small molecule compound
2-[(3-fluorobenzyl)sulfanyl]-5-(4-methylphenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK914399
SMILES Cc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(=O)[nH]c(n2)SCc1cccc(c1)F
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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 C25H22FN3O2S MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN3O2S/c1-14-8-10-16(11-9-14)20-21-18(6-3-7-19(21)30)27-23-22(20)24(31)29-25(28-23)32-13-15-4-2-5-17(26)12-15/h2,4-5,8-12,20H,3,6-7,13H2,1H3,(H2,27,28,29,31)InChIKey
DLZUCPMONZJFMT-UHFFFAOYSA-NSynonyms
2((3fluorobenzyl)sulfanyl)5(4methylphenyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2((3fluorophenyl)methylsulfanyl)5(4methylphenyl)1578910hexahydropyrimido(45b)quinoline46dione
CC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC4=C2C(=O)N=C(N4)SCC5=CC(=CC=C5)F
Cc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(=O)(nH)c(n2)SCc1cccc(c1)F
InChI=1SC25H22FN3O2Sc11481016(11914)202118(63719(21)30)272322(20)24(31)2925(2823)32131542517(26)1215h24581220H36713H21H3(H227282931)
MFCD14729948
ZINC000004793477
ZINC000004793485
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