Vitas-M small molecule compound
3-(3-methoxyphenyl)-2-(prop-2-en-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK541841
SMILES C=CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)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 C26H26N2O2S MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2S/c1-3-15-31-25-27-23-21-12-5-4-9-18(21)17-26(13-6-7-14-26)22(23)24(29)28(25)19-10-8-11-20(16-19)30-2/h3-5,8-12,16H,1,6-7,13-15,17H2,2H3InChIKey
CKFBEFCPOOEJPY-UHFFFAOYSA-NSynonyms
489465-13-62(allylthio)3(3methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3methoxyphenyl)2(prop2en1ylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3METHOXYPHENYL)2PROP2ENYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
489465136
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC=C
InChI=1SC26H26N2O2Sc131531252723211254918(21)1726(13671426)22(23)24(29)28(25)191081120(1619)302h3581216H167131517H22H3
MFCD03297829
ZINC000001821946
ZINC01821946
ZINC1821946
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