Vitas-M small molecule compound
5-[1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl]-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-4-one
Catalog ID
STL409667
SMILES CC1=Nc2c(C(S1)c1cc3cccc4c3n(c1=O)CC4)c(nn2C1CCOC(C1)(C)C)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 C24H26N4O3S MW 450.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O3S/c1-13-25-21-18(22(29)26-28(21)16-8-10-31-24(2,3)12-16)20(32-13)17-11-15-6-4-5-14-7-9-27(19(14)15)23(17)30/h4-6,11,16,20H,7-10,12H2,1-3H3,(H,26,29)InChIKey
WOFHKDCQIHBCFI-UHFFFAOYSA-NSynonyms
1574366-59-81574366598
5(1(22dimethyltetrahydro2Hpyran4yl)3hydroxy6methyl14dihydropyrazolo(34d)(13)thiazin4yl)12dihydro4Hpyrrolo(321ij)quinolin4one
CC1=NC2=C(C(S1)C3=CC4=C5C(=CC=C4)CCN5C3=O)C(=O)NN2C6CCOC(C6)(C)C
InChI=1SC24H26N4O3Sc113252118(22(29)2628(21)168103124(23)1216)20(3213)171115645147927(19(14)15)23(17)30h46111620H71012H213H3(H2629)
MFCD30705826
ZINC000096116945
ZINC000096116948
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