Vitas-M small molecule compound
8,8-dimethyl-2-[(3-methylbenzyl)sulfanyl]-5-(propan-2-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STL193572
SMILES CC(C1C2=C(Nc3c1c(=O)[nH]c(n3)SCc1cccc(c1)C)CC(CC2=O)(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 C24H29N3O2S MW 423.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O2S/c1-13(2)18-19-16(10-24(4,5)11-17(19)28)25-21-20(18)22(29)27-23(26-21)30-12-15-8-6-7-14(3)9-15/h6-9,13,18H,10-12H2,1-5H3,(H2,25,26,27,29)InChIKey
YEIUVRKLZLUHDW-UHFFFAOYSA-NSynonyms
88dimethyl2((3methylbenzyl)sulfanyl)5(propan2yl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
88dimethyl2((3methylphenyl)methylsulfanyl)5propan2yl57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC(C1C2=C(Nc3c1c(=O)(nH)c(n3)SCc1cccc(c1)C)CC(CC2=O)(C)C)C
CC1=CC(=CC=C1)CSC2=NC(=O)C3=C(N2)NC4=C(C3C(C)C)C(=O)CC(C4)(C)C
InChI=1SC24H29N3O2Sc113(2)181916(1024(45)1117(19)28)252120(18)22(29)2723(2621)30121586714(3)915h691318H1012H215H3(H225262729)
MFCD14730508
ZINC000004872302
ZINC000004872326
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