Vitas-M small molecule compound
9-(methylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-7(11H)-one
Catalog ID
STL045082
SMILES CSc1n[nH]c2n1c(=O)c1c(n2)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 C19H20N4OS MW 352.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4OS/c1-25-18-22-21-17-20-15-13-8-4-3-7-12(13)11-19(9-5-2-6-10-19)14(15)16(24)23(17)18/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,20,21)InChIKey
BUWMQTXKECMREG-UHFFFAOYSA-NSynonyms
672890-54-9672890549
9(methylsulfanyl)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclohexan)7(11H)one
CSC1=NNC2=NC3=C(C(=O)N21)C4(CCCCC4)CC5=CC=CC=C53
CSc1n(nH)c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2
InChI=1SC19H20N4OSc12518222117201513843712(13)1119(95261019)14(15)16(24)23(17)18h3478H256911H21H3(H2021)
MFCD03812001
ZINC000100492900
ZINC100492900
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