Vitas-M small molecule compound
9-(ethylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-7(11H)-one
Catalog ID
STL036892
SMILES CCSc1n[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 C20H22N4OS MW 366.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4OS/c1-2-26-19-23-22-18-21-16-14-9-5-4-8-13(14)12-20(10-6-3-7-11-20)15(16)17(25)24(18)19/h4-5,8-9H,2-3,6-7,10-12H2,1H3,(H,21,22)InChIKey
CVAFMZFGNMLJEQ-UHFFFAOYSA-NSynonyms
671763-70-5671763705
9(ethylsulfanyl)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclohexan)7(11H)one
CCSC1=NNC2=NC3=C(C(=O)N21)C4(CCCCC4)CC5=CC=CC=C53
CCSc1n(nH)c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2
InChI=1SC20H22N4OSc122619232218211614954813(14)1220(106371120)15(16)17(25)24(18)19h4589H23671012H21H3(H2122)
MFCD03795186
ZINC000100512568
ZINC100512568
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