Vitas-M small molecule compound
3-cyclohexyl-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK698901
SMILES CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)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 C28H38N2OS MW 450.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H38N2OS/c1-2-3-12-19-32-27-29-25-23-16-9-8-13-21(23)20-28(17-10-5-11-18-28)24(25)26(31)30(27)22-14-6-4-7-15-22/h8-9,13,16,22H,2-7,10-12,14-15,17-20H2,1H3InChIKey
YCALCZOQOKZDSC-UHFFFAOYSA-NSynonyms
337487-73-7337487737
3cyclohexyl2(pentylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3cyclohexyl2(pentylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3CYCLOHEXYL2PENTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
3CYCLOHEXYL2PENTYLTHIOSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCCCSC1=NC2=C(C(=O)N1C3CCCCC3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC28H38N2OSc1231219322729252316981321(23)2028(17105111828)24(25)26(31)30(27)22146471522h89131622H27101214151720H21H3
MFCD01877235
ZINC000002272417
ZINC02272417
ZINC2272417
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