Vitas-M small molecule compound
1-(butylsulfanyl)-7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STL324651
SMILES CCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)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 C22H24N4O2S2 MW 440.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O2S2/c1-4-5-11-29-21-24-23-20-25(14-9-7-6-8-10-14)18(27)17-15-12-22(2,3)28-13-16(15)30-19(17)26(20)21/h6-10H,4-5,11-13H2,1-3H3InChIKey
WQTSVSQJXCWHHU-UHFFFAOYSA-NSynonyms
371782-12-61(butylsulfanyl)77dimethyl4phenyl69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(butylthio)77dimethyl4phenyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
371782126
CCCCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)(C)C)C(=O)N2C5=CC=CC=C5
InChI=1SC22H24N4O2S2c14511292124232025(1497681014)18(27)17151222(23)281316(15)3019(17)26(20)21h610H451113H213H3
MFCD01558824
ZINC000002254575
ZINC02254575
ZINC2254575
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