Vitas-M small molecule compound
3-benzyl-2-[(4-bromobenzyl)sulfanyl]-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK993140
SMILES Brc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)(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 C25H23BrN2O2S2 MW 527.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrN2O2S2/c1-25(2)12-19-20(14-30-25)32-22-21(19)23(29)28(13-16-6-4-3-5-7-16)24(27-22)31-15-17-8-10-18(26)11-9-17/h3-11H,12-15H2,1-2H3InChIKey
MJQRDGJKXJROFA-UHFFFAOYSA-NSynonyms
3benzyl2((4bromobenzyl)sulfanyl)66dimethyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3benzyl2((4bromophenyl)methylsulfanyl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)Br)CC5=CC=CC=C5)C
InChI=1SC25H23BrN2O2S2c125(2)121920(143025)322221(19)23(29)28(13166435716)24(2722)31151781018(26)11917h311H1215H212H3
MFCD02631094
ZINC000008432091
ZINC08432091
ZINC8432091
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