Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-8,8-dimethyl-5-(thiophen-2-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK980839
SMILES O=C1CC(C)(C)CC2=C1C(c1cccs1)c1c(N2)nc([nH]c1=O)SCc1ccccc1Cl
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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 C24H22ClN3O2S2 MW 484.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O2S2/c1-24(2)10-15-18(16(29)11-24)19(17-8-5-9-31-17)20-21(26-15)27-23(28-22(20)30)32-12-13-6-3-4-7-14(13)25/h3-9,19H,10-12H2,1-2H3,(H2,26,27,28,30)InChIKey
QLVNWOWAHKGHEB-UHFFFAOYSA-NSynonyms
2((2chlorobenzyl)sulfanyl)88dimethyl5(thiophen2yl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2((2chlorophenyl)methylsulfanyl)88dimethyl5thiophen2yl57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC1(CC2=C(C(C3=C(N2)NC(=NC3=O)SCC4=CC=CC=C4Cl)C5=CC=CS5)C(=O)C1)C
InChI=1SC24H22ClN3O2S2c124(2)101518(16(29)1124)19(178593117)2021(2615)2723(2822(20)30)321213634714(13)25h3919H1012H212H3(H226272830)
MFCD04213530
O=C1CC(C)(C)CC2=C1C(c1cccs1)c1c(N2)nc((nH)c1=O)SCc1ccccc1Cl
ZINC000016293183
ZINC000016293186
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