Vitas-M small molecule compound
3-(2-methoxyphenyl)-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK530311
SMILES CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1OC)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 C29H34N2O2S MW 474.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O2S/c1-3-4-12-19-34-28-30-26-22-14-7-6-13-21(22)20-29(17-10-5-11-18-29)25(26)27(32)31(28)23-15-8-9-16-24(23)33-2/h6-9,13-16H,3-5,10-12,17-20H2,1-2H3InChIKey
VNKQFAPOKPDZTQ-UHFFFAOYSA-NSynonyms
3(2methoxyphenyl)2(pentylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methoxyphenyl)2(pentylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHOXYPHENYL)2PENTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3OC)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2O2Sc1341219342830262214761321(22)2029(17105111829)25(26)27(32)31(28)2315891624(23)332h691316H3510121720H212H3
MFCD01993008
ZINC000002294120
ZINC02294120
ZINC2294120
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