Vitas-M small molecule compound

2-[(2-oxo-2-phenylethyl)sulfanyl]-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK546164
SMILES CCCn1c(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 C28H30N2O2S MW 458.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O2S/c1-2-17-30-26(32)24-25(29-27(30)33-19-23(31)20-11-5-3-6-12-20)22-14-8-7-13-21(22)18-28(24)15-9-4-10-16-28/h3,5-8,11-14H,2,4,9-10,15-19H2,1H3
InChIKey
GPAKNFBEYDMMDT-UHFFFAOYSA-N
Synonyms
488794-29-2
2((2oxo2phenylethyl)sulfanyl)3propyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2oxo2phenylethyl)thio)3propyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2PHENACYLSULFANYL3PROPYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
488794292
CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CC=C5
InChI=1SC28H30N2O2Sc12173026(32)2425(2927(30)331923(31)20115361220)2214871321(22)1828(24)1594101628h3581114H249101519H21H3
MFCD03292673
ZINC000002341925
ZINC02341925
ZINC2341925

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Available files

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