Vitas-M small molecule compound
2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3-(prop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK553232
SMILES C=CCn1c(SCC(=O)N2CCCCC2)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 C26H31N3O2S MW 449.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O2S/c1-2-14-29-24(31)22-23(27-25(29)32-18-21(30)28-15-8-3-9-16-28)20-11-5-4-10-19(20)17-26(22)12-6-7-13-26/h2,4-5,10-11H,1,3,6-9,12-18H2InChIKey
QJUJJRBTOCUMRN-UHFFFAOYSA-NSynonyms
799807-18-42((2oxo2(piperidin1yl)ethyl)sulfanyl)3(prop2en1yl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(2OXO2PIPERIDIN1YLETHYL)SULFANYL3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
3allyl2((2oxo2(piperidin1yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
799807184
C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)N5CCCCC5
InChI=1SC26H31N3O2Sc12142924(31)2223(2725(29)321821(30)28158391628)2011541019(20)1726(22)12671326h2451011H13691218H2
MFCD03679399
ZINC000002226038
ZINC02226038
ZINC2226038
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