Vitas-M small molecule compound

3-(3-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one

Catalog ID
STK543964
SMILES C=CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)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 C26H26N2OS MW 414.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2OS/c1-3-15-30-25-27-23-21-12-5-4-10-19(21)17-26(13-6-7-14-26)22(23)24(29)28(25)20-11-8-9-18(2)16-20/h3-5,8-12,16H,1,6-7,13-15,17H2,2H3
InChIKey
BAEAYEWGOUEGMW-UHFFFAOYSA-N
Synonyms
488795-83-1
2(allylthio)3(mtolyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3methylphenyl)2(prop2en1ylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3METHYLPHENYL)2PROP2ENYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
488795831
CC1=CC(=CC=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC=C
InChI=1SC26H26N2OSc1315302527232112541019(21)1726(13671426)22(23)24(29)28(25)20118918(2)1620h3581216H167131517H22H3
MFCD03292806
ZINC000002342351
ZINC02342351
ZINC2342351

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Available files

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