Vitas-M small molecule compound
2-[(4-chlorobenzyl)sulfanyl]-3-(prop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK552108
SMILES C=CCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1
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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 C26H25ClN2OS MW 449.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2OS/c1-2-15-29-24(30)22-23(28-25(29)31-17-18-9-11-20(27)12-10-18)21-8-4-3-7-19(21)16-26(22)13-5-6-14-26/h2-4,7-12H,1,5-6,13-17H2InChIKey
QMEMSEBRRLXLKM-UHFFFAOYSA-NSynonyms
799784-46-62((4chlorobenzyl)sulfanyl)3(prop2en1yl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2((4CHLOROPHENYL)METHYLSULFANYL)3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
3allyl2((4chlorobenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
799784466
C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC5=CC=C(C=C5)Cl
InChI=1SC26H25ClN2OSc12152924(30)2223(2825(29)31171891120(27)121018)21843719(21)1626(22)13561426h24712H1561317H2
MFCD03674955
ZINC000013660688
ZINC13660688
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