Vitas-M small molecule compound
9-(pentylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-7(11H)-one
Catalog ID
STL046460
SMILES CCCCCSc1n[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 C23H28N4OS MW 408.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4OS/c1-2-3-9-14-29-22-26-25-21-24-19-17-11-6-5-10-16(17)15-23(12-7-4-8-13-23)18(19)20(28)27(21)22/h5-6,10-11H,2-4,7-9,12-15H2,1H3,(H,24,25)InChIKey
WXLCKMGJTMCNGJ-UHFFFAOYSA-NSynonyms
577997-59-2577997592
9(pentylsulfanyl)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclohexan)7(11H)one
CCCCCSC1=NNC2=NC3=C(C(=O)N21)C4(CCCCC4)CC5=CC=CC=C53
CCCCCSc1n(nH)c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2
InChI=1SC23H28N4OSc123914292226252124191711651016(17)1523(127481323)18(19)20(28)27(21)22h561011H24791215H21H3(H2425)
MFCD04076145
ZINC000101065540
ZINC101065540
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