Vitas-M small molecule compound
3-(2-methylphenyl)-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK530373
SMILES CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)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 C29H34N2OS MW 458.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2OS/c1-3-4-12-19-33-28-30-26-23-15-8-7-14-22(23)20-29(17-10-5-11-18-29)25(26)27(32)31(28)24-16-9-6-13-21(24)2/h6-9,13-16H,3-5,10-12,17-20H2,1-2H3InChIKey
BDYNTIRRIFBNDW-UHFFFAOYSA-NSynonyms
2(pentylthio)3(otolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methylphenyl)2(pentylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHYLPHENYL)2PENTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3C)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2OSc1341219332830262315871422(23)2029(17105111829)25(26)27(32)31(28)2416961321(24)2h691316H3510121720H212H3
MFCD01992999
ZINC000002294532
ZINC02294532
ZINC2294532
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