Vitas-M small molecule compound
4-methyl-1-(prop-2-en-1-ylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK831350
SMILES C=CCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2C)CCCCC3
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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 C22H24N4OS MW 392.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4OS/c1-3-13-28-21-24-23-20-25(2)19(27)17-18(26(20)21)16-10-6-5-9-15(16)14-22(17)11-7-4-8-12-22/h3,5-6,9-10H,1,4,7-8,11-14H2,2H3InChIKey
UQPJDEOBHVLQAN-UHFFFAOYSA-NSynonyms
1(allylthio)4methyl4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
4methyl1(prop2en1ylsulfanyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N5C1=NN=C5SCC=C
InChI=1SC22H24N4OSc1313282124232025(2)19(27)1718(26(20)21)161065915(16)1422(17)117481222h356910H14781114H22H3
MFCD02238874
ZINC000001820339
ZINC1820339
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