Vitas-M small molecule compound
2-(ethylsulfanyl)-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK831355
SMILES CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)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 C26H28N2O2S MW 432.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O2S/c1-3-31-25-27-23-21-13-6-5-10-18(21)17-26(14-7-4-8-15-26)22(23)24(29)28(25)19-11-9-12-20(16-19)30-2/h5-6,9-13,16H,3-4,7-8,14-15,17H2,1-2H3InChIKey
OFPJCMFEHHSASL-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)3(3methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(ethylthio)3(3methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2ETHYLSULFANYL3(3METHOXYPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCSC1=NC2=C(C(=O)N1C3=CC(=CC=C3)OC)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC26H28N2O2Sc13312527232113651018(21)1726(147481526)22(23)24(29)28(25)191191220(1619)302h5691316H3478141517H212H3
MFCD02238311
ZINC000001833002
ZINC01833002
ZINC1833002
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