Vitas-M small molecule compound
6-ethyl-6-methyl-4-[(4-nitrobenzyl)sulfanyl]-2-(propylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Catalog ID
STK558666
SMILES CCCSc1nc(SCc2ccc(cc2)[N+](=O)[O-])c2c(n1)sc1c2CC(OC1)(C)CC
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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 C22H25N3O3S3 MW 475.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S3/c1-4-10-29-21-23-19(30-13-14-6-8-15(9-7-14)25(26)27)18-16-11-22(3,5-2)28-12-17(16)31-20(18)24-21/h6-9H,4-5,10-13H2,1-3H3InChIKey
MYGKZDGJNFPSMD-UHFFFAOYSA-NSynonyms
587012-19-9587012199
6ethyl6methyl4((4nitrobenzyl)sulfanyl)2(propylsulfanyl)58dihydro6Hpyrano(4345)thieno(23d)pyrimidine
6ethyl6methyl4((4nitrobenzyl)thio)2(propylthio)68dihydro5Hpyrano(4345)thieno(23d)pyrimidine
6ethyl6methyl4((4nitrophenyl)methylsulfanyl)2propylsulfanyl58dihydropyrano(23)thieno(24b)pyrimidine
CCCSC1=NC2=C(C3=C(S2)COC(C3)(C)CC)C(=N1)SCC4=CC=C(C=C4)(N+)(=O)(O)
CCCSc1nc(SCc2ccc(cc2)(N+)(=O)(O))c2c(n1)sc1c2CC(OC1)(C)CC
InChI=1SC22H25N3O3S3c141029212319(3013146815(9714)25(26)27)18161122(352)281217(16)3120(18)2421h69H451013H213H3
MFCD04033836
ZINC000001863398
ZINC000001863399
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