Vitas-M small molecule compound
3-butyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK547982
SMILES CCCCn1c(SCC(=C)C)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 C25H32N2OS MW 408.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2OS/c1-4-5-15-27-23(28)21-22(26-24(27)29-17-18(2)3)20-12-8-7-11-19(20)16-25(21)13-9-6-10-14-25/h7-8,11-12H,2,4-6,9-10,13-17H2,1,3H3InChIKey
XJITVNKKOOAKFY-UHFFFAOYSA-NSynonyms
487023-79-03butyl2((2methylallyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3butyl2((2methylprop2en1yl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BUTYL2(2METHYLPROP2ENYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
487023790
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=C)C
InChI=1SC25H32N2OSc145152723(28)2122(2624(27)291718(2)3)2012871119(20)1625(21)1396101425h781112H2469101317H213H3
MFCD03286572
ZINC000002321163
ZINC02321163
ZINC2321163
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