Vitas-M small molecule compound
5-(3,4-dimethoxyphenyl)-8,8-dimethyl-2-(methylsulfanyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK980759
SMILES COc1ccc(cc1OC)C1C2=C(Nc3c1c(=O)[nH]c(n3)SC)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 C22H25N3O4S MW 427.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O4S/c1-22(2)9-12-17(13(26)10-22)16(11-6-7-14(28-3)15(8-11)29-4)18-19(23-12)24-21(30-5)25-20(18)27/h6-8,16H,9-10H2,1-5H3,(H2,23,24,25,27)InChIKey
CONXEQMKKDQRLS-UHFFFAOYSA-NSynonyms
537044-19-25(34dimethoxyphenyl)88dimethyl2(methylsulfanyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
5(34dimethoxyphenyl)88dimethyl2methylsulfanyl57910tetrahydro1Hpyrimido(45b)quinoline46dione
537044192
CC1(CC2=C(C(C3=C(N2)NC(=NC3=O)SC)C4=CC(=C(C=C4)OC)OC)C(=O)C1)C
COc1ccc(cc1OC)C1C2=C(Nc3c1c(=O)(nH)c(n3)SC)CC(CC2=O)(C)C
InChI=1SC22H25N3O4Sc122(2)91217(13(26)1022)16(116714(283)15(811)294)1819(2312)2421(305)2520(18)27h6816H910H215H3(H223242527)
MFCD04457337
ZINC000017242271
ZINC000017242276
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