Vitas-M small molecule compound
8,8-dimethyl-2-(prop-2-en-1-ylsulfanyl)-5-(pyridin-4-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918737
SMILES C=CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccncc1)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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-4-9-28-20-24-18-17(19(27)25-20)15(12-5-7-22-8-6-12)16-13(23-18)10-21(2,3)11-14(16)26/h4-8,15H,1,9-11H2,2-3H3,(H2,23,24,25,27)InChIKey
LMZHXDWNTQZCHE-UHFFFAOYSA-NSynonyms
627048-12-8627048128
88dimethyl2(prop2en1ylsulfanyl)5(pyridin4yl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
88dimethyl2prop2enylsulfanyl5pyridin4yl57910tetrahydro1Hpyrimido(45b)quinoline46dione
C=CCSc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccncc1)C(=O)CC(C3)(C)C
CC1(CC2=C(C(C3=C(N2)NC(=NC3=O)SCC=C)C4=CC=NC=C4)C(=O)C1)C
InChI=1SC21H22N4O2Sc1492820241817(19(27)2520)15(1257228612)1613(2318)1021(23)1114(16)26h4815H1911H223H3(H223242527)
MFCD04444000
ZINC000005864481
ZINC000005864595
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