Vitas-M small molecule compound
2-(pentylsulfanyl)-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK698958
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 C28H32N2OS MW 444.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2OS/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/h4,6-9,13-16H,2-3,5,10-12,17-20H2,1H3InChIKey
ZGPQPJXESDQYOI-UHFFFAOYSA-NSynonyms
2(pentylsulfanyl)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(pentylthio)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2PENTYLSULFANYL3PHENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC28H32N2OSc1231219322729252316981321(23)2028(17105111828)24(25)26(31)30(27)22146471522h4691316H23510121720H21H3
MFCD01807159
ZINC000001822167
ZINC01822167
ZINC1822167
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