Vitas-M small molecule compound
2-(butylsulfanyl)-9-methyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4-ol
Catalog ID
STL046495
SMILES CCCCSc1nc(O)c2c(n1)c1cc(C)ccc1CC12CCCCC1
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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 C22H28N2OS MW 368.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2OS/c1-3-4-12-26-21-23-19-17-13-15(2)8-9-16(17)14-22(10-6-5-7-11-22)18(19)20(25)24-21/h8-9,13H,3-7,10-12,14H2,1-2H3,(H,23,24,25)InChIKey
WCOCOQNLEXBHSV-UHFFFAOYSA-NSynonyms
497075-58-82(butylsulfanyl)9methyl6Hspiro(benzo(h)quinazoline51cyclohexan)4ol
2BUTYLSULFANYL9METHYLSPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
497075588
CCCCSC1=NC(=O)C2=C(N1)C3=C(CC24CCCCC4)C=CC(=C3)C
InChI=1SC22H28N2OSc1341226212319171315(2)8916(17)1422(106571122)18(19)20(25)2421h8913H37101214H212H3(H232425)
MFCD03812798
ZINC000009186493
ZINC09186493
ZINC9186493
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