Vitas-M small molecule compound
5-(4-chlorophenyl)-2-[(4-methylbenzyl)sulfanyl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918675
SMILES Cc1ccc(cc1)CSc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccc(cc1)Cl)C(=O)CCC3
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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 C25H22ClN3O2S MW 463.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O2S/c1-14-5-7-15(8-6-14)13-32-25-28-23-22(24(31)29-25)20(16-9-11-17(26)12-10-16)21-18(27-23)3-2-4-19(21)30/h5-12,20H,2-4,13H2,1H3,(H2,27,28,29,31)InChIKey
NEJZMWJVWOAKAT-UHFFFAOYSA-NSynonyms
5(4chlorophenyl)2((4methylbenzyl)sulfanyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
5(4chlorophenyl)2((4methylphenyl)methylsulfanyl)1578910hexahydropyrimido(45b)quinoline46dione
CC1=CC=C(C=C1)CSC2=NC(=O)C3=C(N2)NC4=C(C3C5=CC=C(C=C5)Cl)C(=O)CCC4
Cc1ccc(cc1)CSc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccc(cc1)Cl)C(=O)CCC3
InChI=1SC25H22ClN3O2Sc1145715(8614)133225282322(24(31)2925)20(1691117(26)121016)2118(2723)32419(21)30h51220H2413H21H3(H227282931)
MFCD05988970
ZINC000016345553
ZINC000016345556
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