Vitas-M small molecule compound
8,8-dimethyl-5-phenyl-2-(propan-2-ylsulfanyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918716
SMILES CC(Sc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccccc1)C(=O)CC(C3)(C)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 C22H25N3O2S MW 395.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2S/c1-12(2)28-21-24-19-18(20(27)25-21)16(13-8-6-5-7-9-13)17-14(23-19)10-22(3,4)11-15(17)26/h5-9,12,16H,10-11H2,1-4H3,(H2,23,24,25,27)InChIKey
ZOCMQGWSCJSENO-UHFFFAOYSA-NSynonyms
88dimethyl5phenyl2(propan2ylsulfanyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
88dimethyl5phenyl2propan2ylsulfanyl57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC(C)SC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=CC=C4)C(=O)CC(C3)(C)C
CC(Sc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccccc1)C(=O)CC(C3)(C)C)C
InChI=1SC22H25N3O2Sc112(2)2821241918(20(27)2521)16(138657913)1714(2319)1022(34)1115(17)26h591216H1011H214H3(H223242527)
MFCD04443987
ZINC000005860792
ZINC000005860926
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