Vitas-M small molecule compound
2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3-(prop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK557723
SMILES C=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 C26H26N2O2S2 MW 462.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2S2/c1-2-14-28-24(30)22-23(27-25(28)32-17-20(29)21-11-8-15-31-21)19-10-5-4-9-18(19)16-26(22)12-6-3-7-13-26/h2,4-5,8-11,15H,1,3,6-7,12-14,16-17H2InChIKey
YWVCRFGNWYYPGV-UHFFFAOYSA-NSynonyms
577790-10-42((2oxo2(thiophen2yl)ethyl)sulfanyl)3(prop2en1yl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(2OXO2THIOPHEN2YLETHYL)SULFANYL3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
3allyl2((2oxo2(thiophen2yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
577790104
C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CS5
InChI=1SC26H26N2O2S2c12142824(30)2223(2725(28)321720(29)21118153121)191054918(19)1626(22)126371326h24581115H136712141617H2
MFCD04027287
ZINC000002379456
ZINC02379456
ZINC2379456
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