Vitas-M small molecule compound
2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(morpholin-4-yl)ethanone
Catalog ID
STL235380
SMILES O=C(N1CCOCC1)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)n1nc(cc1C)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 C22H27N5O3S2 MW 473.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O3S2/c1-13-9-14(2)27(25-13)21-23-19(31-12-17(28)26-5-7-29-8-6-26)18-15-10-22(3,4)30-11-16(15)32-20(18)24-21/h9H,5-8,10-12H2,1-4H3InChIKey
BPHCTMIRMFLNOL-UHFFFAOYSA-NSynonyms
1010871-64-31010871643
2((2(35dimethyl1Hpyrazol1yl)66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4yl)sulfanyl)1(morpholin4yl)ethanone
2((2(35dimethyl1Hpyrazol1yl)66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4yl)thio)1morpholinoethanone
2((2(35dimethylpyrazol1yl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4yl)sulfanyl)1morpholin4ylethanone
CC1=CC(=NN1C2=NC3=C(C4=C(S3)COC(C4)(C)C)C(=N2)SCC(=O)N5CCOCC5)C
InChI=1SC22H27N5O3S2c113914(2)27(2513)212319(311217(28)2657298626)18151022(34)301116(15)3220(18)2421h9H581012H214H3
MFCD05704459
ZINC000009346059
ZINC09346059
ZINC9346059
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