Vitas-M small molecule compound
3-(3-methoxyphenyl)-2-(methylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK835461
SMILES CSc1nc2c3ccccc3CC3(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 C25H26N2O2S MW 418.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O2S/c1-29-19-11-8-10-18(15-19)27-23(28)21-22(26-24(27)30-2)20-12-5-4-9-17(20)16-25(21)13-6-3-7-14-25/h4-5,8-12,15H,3,6-7,13-14,16H2,1-2H3InChIKey
FURKQMUSVUSYBJ-UHFFFAOYSA-NSynonyms
3(3methoxyphenyl)2(methylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3methoxyphenyl)2(methylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3METHOXYPHENYL)2METHYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SC
InChI=1SC25H26N2O2Sc129191181018(1519)2723(28)2122(2624(27)302)201254917(20)1625(21)136371425h4581215H367131416H212H3
MFCD02240183
ZINC000001786136
ZINC01786136
ZINC1786136
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