Vitas-M small molecule compound
2-(benzylsulfanyl)-9-methyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4-ol
Catalog ID
STL047832
SMILES Cc1ccc2c(c1)c1nc(SCc3ccccc3)nc(c1C1(C2)CCCCC1)O
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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 C25H26N2OS MW 402.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2OS/c1-17-10-11-19-15-25(12-6-3-7-13-25)21-22(20(19)14-17)26-24(27-23(21)28)29-16-18-8-4-2-5-9-18/h2,4-5,8-11,14H,3,6-7,12-13,15-16H2,1H3,(H,26,27,28)InChIKey
QLFSIONEZUDWSH-UHFFFAOYSA-NSynonyms
497076-84-32(benzylsulfanyl)9methyl6Hspiro(benzo(h)quinazoline51cyclohexan)4ol
2BENZYLSULFANYL9METHYLSPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
497076843
CC1=CC2=C(CC3(CCCCC3)C4=C2NC(=NC4=O)SCC5=CC=CC=C5)C=C1
InChI=1SC25H26N2OSc1171011191525(126371325)2122(20(19)1417)2624(2723(21)28)2916188425918h24581114H36712131516H21H3(H262728)
MFCD03809709
ZINC000009046851
ZINC9046851
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