Vitas-M small molecule compound

3-ethyl-2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK555474
SMILES CCn1c(SCC(=O)c2cccs2)nc2c(c1=O)C1(CCCCC1)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 C25H26N2O2S2 MW 450.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O2S2/c1-2-27-23(29)21-22(26-24(27)31-16-19(28)20-11-8-14-30-20)18-10-5-4-9-17(18)15-25(21)12-6-3-7-13-25/h4-5,8-11,14H,2-3,6-7,12-13,15-16H2,1H3
InChIKey
WJHPGFYSTLOKOX-UHFFFAOYSA-N
Synonyms
841207-99-6
3ethyl2((2oxo2(thiophen2yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3ethyl2((2oxo2(thiophen2yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3ETHYL2(2OXO2THIOPHEN2YLETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
841207996
CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CS5
InChI=1SC25H26N2O2S2c122723(29)2122(2624(27)311619(28)20118143020)181054917(18)1525(21)126371325h4581114H236712131516H21H3
MFCD04011464
ZINC000002388243
ZINC02388243
ZINC2388243

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Available files

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