Vitas-M small molecule compound
3-benzyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK698894
SMILES CC(=C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C27H28N2OS MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2OS/c1-19(2)18-31-26-28-24-22-13-7-6-12-21(22)16-27(14-8-9-15-27)23(24)25(30)29(26)17-20-10-4-3-5-11-20/h3-7,10-13H,1,8-9,14-18H2,2H3InChIKey
PVWPLLUVQBTQJO-UHFFFAOYSA-NSynonyms
337487-56-62(2METHYLPROP2ENYLTHIO)3BENZYLSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
337487566
3benzyl2((2methylallyl)thio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3benzyl2((2methylprop2en1yl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3BENZYL2(2METHYLPROP2ENYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
CC(=C)CSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC27H28N2OSc119(2)18312628242213761221(22)1627(14891527)23(24)25(30)29(26)1720104351120h371013H1891418H22H3
MFCD01876476
ZINC000002271825
ZINC02271825
ZINC2271825
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