Vitas-M small molecule compound

3-propyl-2-sulfanyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one

Catalog ID
STK560474
SMILES CCCn1c(S)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 C19H22N2OS MW 326.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2OS/c1-2-11-21-17(22)15-16(20-18(21)23)14-8-4-3-7-13(14)12-19(15)9-5-6-10-19/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,20,23)
InChIKey
GWEKNFAIHANUHW-UHFFFAOYSA-N
Synonyms
500272-57-1
3propyl2sulfanyl3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3PROPYL2SULFANYLIDENESPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
500272571
CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)NC1=S
InChI=1SC19H22N2OSc12112117(22)1516(2018(21)23)14843713(14)1219(15)9561019h3478H256912H21H3(H2023)
MFCD03811298
ZINC000001248207
ZINC01248207
ZINC1248207

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.