Vitas-M small molecule compound
1-(benzylsulfanyl)-6-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK829940
SMILES O=c1c2c3C(C)CCCc3sc2n2c(n1c1ccccc1)nnc2SCc1ccccc1
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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 C25H22N4OS2 MW 458.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4OS2/c1-16-9-8-14-19-20(16)21-22(30)28(18-12-6-3-7-13-18)24-26-27-25(29(24)23(21)32-19)31-15-17-10-4-2-5-11-17/h2-7,10-13,16H,8-9,14-15H2,1H3InChIKey
QZOAUDYTKLSASA-UHFFFAOYSA-NSynonyms
1(benzylsulfanyl)6methyl4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(benzylthio)6methyl4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1CCCC2=C1C3=C(S2)N4C(=NN=C4SCC5=CC=CC=C5)N(C3=O)C6=CC=CC=C6
InChI=1SC25H22N4OS2c11698141920(16)2122(30)28(18126371318)24262725(29(24)23(21)3219)311517104251117h27101316H891415H21H3
MFCD02234382
ZINC000002292493
ZINC000002292494
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