Vitas-M small molecule compound
3-butyl-2-(butylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK546463
SMILES CCCCn1c(SCCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C25H34N2OS MW 410.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N2OS/c1-3-5-16-27-23(28)21-22(26-24(27)29-17-6-4-2)20-13-9-8-12-19(20)18-25(21)14-10-7-11-15-25/h8-9,12-13H,3-7,10-11,14-18H2,1-2H3InChIKey
RUVMCCXDORSXAG-UHFFFAOYSA-NSynonyms
489463-44-73butyl2(butylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3butyl2(butylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BUTYL2BUTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
489463447
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCCCC
InChI=1SC25H34N2OSc135162723(28)2122(2624(27)2917642)2013981219(20)1825(21)14107111525h891213H3710111418H212H3
MFCD03297667
ZINC000002280382
ZINC02280382
ZINC2280382
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