Vitas-M small molecule compound
2-(pentylsulfanyl)-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK551496
SMILES CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)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 C29H34N2OS MW 458.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2OS/c1-2-3-11-20-33-28-30-26-24-15-8-7-14-23(24)21-29(17-9-10-18-29)25(26)27(32)31(28)19-16-22-12-5-4-6-13-22/h4-8,12-15H,2-3,9-11,16-21H2,1H3InChIKey
YBQJVFGILWSACR-UHFFFAOYSA-NSynonyms
380667-31-22(pentylsulfanyl)3(2phenylethyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(pentylthio)3phenethyl3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2pentylsulfanyl3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclopentane)4one
2PENTYLSULFANYL3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
380667312
CCCCCSC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2OSc1231120332830262415871423(24)2129(179101829)25(26)27(32)31(28)191622125461322h481215H239111621H21H3
MFCD03677231
ZINC000002220410
ZINC02220410
ZINC2220410
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