Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK000157
SMILES CCn1c(SCC(=O)c2ccc(cc2)Br)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 C26H25BrN2O2S MW 509.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN2O2S/c1-2-29-24(31)22-23(20-8-4-3-7-18(20)15-26(22)13-5-6-14-26)28-25(29)32-16-21(30)17-9-11-19(27)12-10-17/h3-4,7-12H,2,5-6,13-16H2,1H3InChIKey
QXTRHUGCRNFAEQ-UHFFFAOYSA-NSynonyms
337494-99-22((2(4BROMOPHENYL)2OXOETHYL)SULFANYL)3ETHYL3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)4(6H)ONE
2((2(4bromophenyl)2oxoethyl)thio)3ethyl3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(2(4BROMOPHENYL)2OXOETHYL)SULFANYL3ETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
2(2(4BROMOPHENYL)2OXOETHYLTHIO)3ETHYLSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
337494992
CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)C5=CC=C(C=C5)Br
CCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1
InChI=1SC26H25BrN2O2Sc122924(31)2223(20843718(20)1526(22)13561426)2825(29)321621(30)1791119(27)121017h34712H2561316H21H3
MFCD01556957
STK000157
ZINC000002262179
ZINC02262179
ZINC2262179
Check stock
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Check stock on Vitas-MAvailable files
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