Vitas-M small molecule compound
4-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Catalog ID
STK545740
SMILES CCc1nc(SCc2ccc3c(c2)OCO3)c2c(n1)sc1c2CC(OC1)(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 C21H22N2O3S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S2/c1-4-17-22-19(27-10-12-5-6-14-15(7-12)25-11-24-14)18-13-8-21(2,3)26-9-16(13)28-20(18)23-17/h5-7H,4,8-11H2,1-3H3InChIKey
KPJNRFSWKLVIIZ-UHFFFAOYSA-NSynonyms
488747-91-74((13benzodioxol5ylmethyl)sulfanyl)2ethyl66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidine
4((benzo(d)(13)dioxol5ylmethyl)thio)2ethyl66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidine
4(13benzodioxol5ylmethylsulfanyl)2ethyl66dimethyl58dihydropyrano(23)thieno(24d)pyrimidine
488747917
CCC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=N1)SCC4=CC5=C(C=C4)OCO5
InChI=1SC21H22N2O3S2c14172219(271012561415(712)25112414)1813821(23)26916(13)2820(18)2317h57H4811H213H3
MFCD03292517
ZINC000002340845
ZINC02340845
ZINC2340845
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