Vitas-M small molecule compound

2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide

Catalog ID
STK805053
SMILES C=CCn1c(SCC(=O)N)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 C22H25N3O2S MW 395.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2S/c1-2-12-25-20(27)18-19(24-21(25)28-14-17(23)26)16-9-5-4-8-15(16)13-22(18)10-6-3-7-11-22/h2,4-5,8-9H,1,3,6-7,10-14H2,(H2,23,26)
InChIKey
JOKGJQNRIVKHQV-UHFFFAOYSA-N
Synonyms
332849-62-4
2((3allyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
2((4oxo3(prop2en1yl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
2(4OXO3PROP2ENYLSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YLTHIO)ACETAMIDE
2(4OXO3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
332849624
C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)N
InChI=1SC22H25N3O2Sc12122520(27)1819(2421(25)281417(23)26)16954815(16)1322(18)106371122h24589H13671014H2(H22326)
MFCD01807152
ZINC000000865026
ZINC00865026
ZINC865026

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Available files

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