Vitas-M small molecule compound
8,8-dimethyl-5-(3-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918741
SMILES C=CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1cccc(c1)C)C(=O)CC(C3)(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 C23H25N3O2S MW 407.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O2S/c1-5-9-29-22-25-20-19(21(28)26-22)17(14-8-6-7-13(2)10-14)18-15(24-20)11-23(3,4)12-16(18)27/h5-8,10,17H,1,9,11-12H2,2-4H3,(H2,24,25,26,28)InChIKey
DHAFEWBOIFKTDO-UHFFFAOYSA-NSynonyms
88dimethyl5(3methylphenyl)2(prop2en1ylsulfanyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
88dimethyl5(3methylphenyl)2prop2enylsulfanyl57910tetrahydro1Hpyrimido(45b)quinoline46dione
C=CCSc1nc2NC3=C(C(c2c(=O)(nH)1)c1cccc(c1)C)C(=O)CC(C3)(C)C
CC1=CC=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=C2C(=O)N=C(N4)SCC=C
InChI=1SC23H25N3O2Sc1592922252019(21(28)2622)17(1486713(2)1014)1815(2420)1123(34)1216(18)27h581017H191112H224H3(H224252628)
MFCD06305315
ZINC000033810392
ZINC000033810393
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