Vitas-M small molecule compound
2-(butan-2-ylsulfanyl)-5-phenyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918698
SMILES CCC(Sc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccccc1)C(=O)CCC3)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 C21H23N3O2S MW 381.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S/c1-3-12(2)27-21-23-19-18(20(26)24-21)16(13-8-5-4-6-9-13)17-14(22-19)10-7-11-15(17)25/h4-6,8-9,12,16H,3,7,10-11H2,1-2H3,(H2,22,23,24,26)InChIKey
JIKMAMDNEXYUNM-UHFFFAOYSA-NSynonyms
631853-58-22(butan2ylsulfanyl)5phenyl58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2butan2ylsulfanyl5phenyl1578910hexahydropyrimido(45b)quinoline46dione
631853582
CCC(C)SC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=CC=C4)C(=O)CCC3
CCC(Sc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccccc1)C(=O)CCC3)C
InChI=1SC21H23N3O2Sc1312(2)2721231918(20(26)2421)16(138546913)1714(2219)1071115(17)25h46891216H371011H212H3(H222232426)
MFCD04443964
ZINC000006003408
ZINC000006005321
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