Vitas-M small molecule compound
2-(butylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK059576
SMILES CCCCSc1nc2c3ccccc3CC3(c2c(=O)[nH]1)CCCCC3
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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 C21H26N2OS MW 354.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2OS/c1-2-3-13-25-20-22-18-16-10-6-5-9-15(16)14-21(11-7-4-8-12-21)17(18)19(24)23-20/h5-6,9-10H,2-4,7-8,11-14H2,1H3,(H,22,23,24)InChIKey
UYCNVISHEFSJBX-UHFFFAOYSA-NSynonyms
332167-94-92(BUTYLSULFANYL)1HSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXAN)4(6H)ONE
2(BUTYLSULFANYL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXAN)4(6H)ONE
2(BUTYLTHIO)34DIHYDROSPIRO(BENZO(H)QUINAZOLINE5(6H)1CYCLOHEXANE)4ONE
2(butylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2BUTYLSULFANYLSPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
2BUTYLTHIOSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
332167949
CCCCSC1=NC(=O)C2=C(N1)C3=CC=CC=C3CC24CCCCC4
CCCCSc1nc2c3ccccc3CC3(c2c(=O)(nH)1)CCCCC3
InChI=1SC21H26N2OSc1231325202218161065915(16)1421(117481221)17(18)19(24)2320h56910H24781114H21H3(H222324)
MFCD01556595
STK059576
ZINC000008914284
ZINC08914284
ZINC8914284
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.