Vitas-M small molecule compound
3-(2-methylprop-2-en-1-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK806021
SMILES CC(=C)Cn1c(SCC(=O)c2ccccc2)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 C29H30N2O2S MW 470.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O2S/c1-20(2)18-31-27(33)25-26(30-28(31)34-19-24(32)21-11-5-3-6-12-21)23-14-8-7-13-22(23)17-29(25)15-9-4-10-16-29/h3,5-8,11-14H,1,4,9-10,15-19H2,2H3InChIKey
DZWTXCQVAIEULZ-UHFFFAOYSA-NSynonyms
337495-48-43(2methylallyl)2((2oxo2phenylethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methylprop2en1yl)2((2oxo2phenylethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHYLPROP2ENYL)2PHENACYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
337495484
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CC=C5
InChI=1SC29H30N2O2Sc120(2)183127(33)2526(3028(31)341924(32)21115361221)2314871322(23)1729(25)1594101629h3581114H149101519H22H3
MFCD01558625
ZINC000006073600
ZINC06073600
ZINC6073600
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