Vitas-M small molecule compound
8,8-dimethyl-2-(propan-2-ylsulfanyl)-5-(pyridin-3-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918723
SMILES CC(Sc1nc2NC3=C(C(c2c(=O)[nH]1)c1cccnc1)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 C21H24N4O2S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S/c1-11(2)28-20-24-18-17(19(27)25-20)15(12-6-5-7-22-10-12)16-13(23-18)8-21(3,4)9-14(16)26/h5-7,10-11,15H,8-9H2,1-4H3,(H2,23,24,25,27)InChIKey
KUXFIAMHVIWREK-UHFFFAOYSA-NSynonyms
627048-74-2627048742
88dimethyl2(propan2ylsulfanyl)5(pyridin3yl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
88dimethyl2propan2ylsulfanyl5pyridin3yl57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC(C)SC1=NC(=O)C2=C(N1)NC3=C(C2C4=CN=CC=C4)C(=O)CC(C3)(C)C
CC(Sc1nc2NC3=C(C(c2c(=O)(nH)1)c1cccnc1)C(=O)CC(C3)(C)C)C
InChI=1SC21H24N4O2Sc111(2)2820241817(19(27)2520)15(12657221012)1613(2318)821(34)914(16)26h57101115H89H214H3(H223242527)
MFCD04443990
ZINC000005860783
ZINC000005860917
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