Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-(prop-2-en-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK805984
SMILES C=CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)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/c1-3-16-31-25-27-23-21-9-5-4-8-18(21)17-26(14-6-7-15-26)22(23)24(29)28(25)19-10-12-20(30-2)13-11-19/h3-5,8-13H,1,6-7,14-17H2,2H3InChIKey
ABORCRGVRMHYFP-UHFFFAOYSA-NSynonyms
312585-33-42(ALLYLSULFANYL)3(4METHOXYPHENYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTANE)4(3H)ONE
2(allylthio)3(4methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(4methoxyphenyl)2(prop2en1ylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(4METHOXYPHENYL)2PROP2ENYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
312585334
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC=C
InChI=1SC26H26N2O2Sc13163125272321954818(21)1726(14671526)22(23)24(29)28(25)19101220(302)131119h35813H1671417H22H3
MFCD01174960
ZINC000002117645
ZINC02117645
ZINC2117645
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