Vitas-M small molecule compound
3-(2-methylprop-2-en-1-yl)-2-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK942791
SMILES CC(=C)Cn1c(SCC(=O)c2cc3ccccc3oc2=O)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 C32H30N2O4S MW 538.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O4S/c1-20(2)18-34-29(36)27-28(23-12-6-4-11-22(23)17-32(27)14-8-3-9-15-32)33-31(34)39-19-25(35)24-16-21-10-5-7-13-26(21)38-30(24)37/h4-7,10-13,16H,1,3,8-9,14-15,17-19H2,2H3InChIKey
CPLNEJQCIXYCER-UHFFFAOYSA-NSynonyms
844451-93-03(2methylallyl)2((2oxo2(2oxo2Hchromen3yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methylprop2en1yl)2((2oxo2(2oxo2Hchromen3yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHYLPROP2ENYL)2(2OXO2(2OXOCHROMEN3YL)ETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
844451930
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC6=CC=CC=C6OC5=O
InChI=1SC32H30N2O4Sc120(2)183429(36)2728(2312641122(23)1732(27)148391532)3331(34)391925(35)24162110571326(21)3830(24)37h47101316H138914151719H22H3
MFCD04156622
ZINC000002401795
ZINC2401795
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