Vitas-M small molecule compound
3-(cyclohexylmethyl)-2-(prop-2-yn-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK833052
SMILES C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC1CCCCC1)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 C27H32N2OS MW 432.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2OS/c1-2-17-31-26-28-24-22-14-8-7-13-21(22)18-27(15-9-4-10-16-27)23(24)25(30)29(26)19-20-11-5-3-6-12-20/h1,7-8,13-14,20H,3-6,9-12,15-19H2InChIKey
DGHWQVMVQRZCGN-UHFFFAOYSA-NSynonyms
370076-08-73(cyclohexylmethyl)2(prop2yn1ylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(cyclohexylmethyl)2(prop2yn1ylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(CYCLOHEXYLMETHYL)2PROP2YNYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
370076087
C#CCSC1=NC2=C(C(=O)N1CC3CCCCC3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC27H32N2OSc1217312628242214871321(22)1827(1594101627)23(24)25(30)29(26)1920115361220h178131420H369121519H2
MFCD01175071
ZINC000002346523
ZINC02346523
ZINC2346523
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