Vitas-M small molecule compound
2-(butylsulfanyl)-3-cyclohexyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK832809
SMILES CCCCSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCC3
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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 C26H34N2OS MW 422.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2OS/c1-2-3-17-30-25-27-23-21-14-8-7-11-19(21)18-26(15-9-10-16-26)22(23)24(29)28(25)20-12-5-4-6-13-20/h7-8,11,14,20H,2-6,9-10,12-13,15-18H2,1H3InChIKey
HOUGNDNMDRSVPR-UHFFFAOYSA-NSynonyms
2(butylsulfanyl)3cyclohexyl3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(butylthio)3cyclohexyl3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2BUTYLSULFANYL3CYCLOHEXYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
CCCCSC1=NC2=C(C(=O)N1C3CCCCC3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC26H34N2OSc12317302527232114871119(21)1826(159101626)22(23)24(29)28(25)20125461320h78111420H2691012131518H21H3
MFCD01175076
ZINC000002229955
ZINC02229955
ZINC2229955
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