Vitas-M small molecule compound

12-methyl-9-(methylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-7(12H)-one

Catalog ID
STK551193
SMILES CSc1nnc2n1c(=O)c1c(n2C)c2ccccc2CC21CCCCC2

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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 C20H22N4OS MW 366.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4OS/c1-23-16-14-9-5-4-8-13(14)12-20(10-6-3-7-11-20)15(16)17(25)24-18(23)21-22-19(24)26-2/h4-5,8-9H,3,6-7,10-12H2,1-2H3
InChIKey
YBYDTSLCHORFFU-UHFFFAOYSA-N
Synonyms
799830-62-9
12methyl9(methylsulfanyl)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclohexan)7(12H)one
12methyl9(methylthio)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclohexan)7(12H)one
799830629
CN1C2=C(C(=O)N3C1=NN=C3SC)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC20H22N4OSc1231614954813(14)1220(106371120)15(16)17(25)2418(23)212219(24)262h4589H3671012H212H3
MFCD03684120
ZINC000002245704
ZINC02245704
ZINC2245704

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Available files

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