Vitas-M small molecule compound
1,3-diethyl-5-[(9-methyl-11-oxo-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-10-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK553075
SMILES CCN1C(=S)N(CC)C(=O)C(=Cc2c(=O)oc3c(c2C)cc2c4c3CCCN4CCC2)C1=O
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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 C25H27N3O4S MW 465.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4S/c1-4-27-22(29)19(23(30)28(5-2)25(27)33)13-18-14(3)17-12-15-8-6-10-26-11-7-9-16(20(15)26)21(17)32-24(18)31/h12-13H,4-11H2,1-3H3InChIKey
ICRVZSGXIQLWBO-UHFFFAOYSA-NSynonyms
836642-10-513diethyl5((9methyl11oxo2356711hexahydro1Hpyrano(23f)pyrido(321ij)quinolin10yl)methylene)2thioxodihydropyrimidine46(1H5H)dione
13diethyl5((9methyl11oxo2367tetrahydro1H5H11Hpyrano(23f)pyrido(321ij)quinolin10yl)methylidene)2thioxodihydropyrimidine46(1H5H)dione
836642105
CCN1C(=O)C(=CC2=C(C3=CC4=C5C(=C3OC2=O)CCCN5CCC4)C)C(=O)N(C1=S)CC
InChI=1SC25H27N3O4Sc142722(29)19(23(30)28(52)25(27)33)131814(3)171215861026117916(20(15)26)21(17)3224(18)31h1213H411H213H3
MFCD03690898
ZINC000002251960
ZINC02251960
ZINC2251960
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