Vitas-M small molecule compound
4-benzyl-1-(methylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK525375
SMILES CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccccc1)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 C26H26N4OS MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4OS/c1-32-25-28-27-24-29(17-18-10-4-2-5-11-18)23(31)21-22(30(24)25)20-13-7-6-12-19(20)16-26(21)14-8-3-9-15-26/h2,4-7,10-13H,3,8-9,14-17H2,1H3InChIKey
RFMIPXLJBOXNHF-UHFFFAOYSA-NSynonyms
374542-93-5374542935
4benzyl1(methylsulfanyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
4benzyl1(methylthio)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
CSC1=NN=C2N1C3=C(C(=O)N2CC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC26H26N4OSc1322528272429(1718104251118)23(31)2122(30(24)25)2013761219(20)1626(21)148391526h2471013H3891417H21H3
MFCD01955957
ZINC000013774970
ZINC13774970
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