Vitas-M small molecule compound
3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK547674
SMILES CCCCn1c(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 C29H32N2O2S MW 472.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O2S/c1-2-3-18-31-27(33)25-26(30-28(31)34-20-24(32)21-12-6-4-7-13-21)23-15-9-8-14-22(23)19-29(25)16-10-5-11-17-29/h4,6-9,12-15H,2-3,5,10-11,16-20H2,1H3InChIKey
MWGDJFAFHIESKI-UHFFFAOYSA-NSynonyms
488107-41-13butyl2((2oxo2phenylethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3butyl2((2oxo2phenylethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BUTYL2PHENACYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
488107411
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CC=C5
InChI=1SC29H32N2O2Sc123183127(33)2526(3028(31)342024(32)21126471321)2315981422(23)1929(25)16105111729h4691215H23510111620H21H3
MFCD03288835
ZINC000002328662
ZINC02328662
ZINC2328662
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