Vitas-M small molecule compound

2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK805045
SMILES CC(=C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

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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 C27H28N2OS MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2OS/c1-19(2)18-31-26-28-24-22-14-8-7-11-20(22)17-27(15-9-4-10-16-27)23(24)25(30)29(26)21-12-5-3-6-13-21/h3,5-8,11-14H,1,4,9-10,15-18H2,2H3
InChIKey
RPLALAOIZYUTQC-UHFFFAOYSA-N
Synonyms
332849-63-5
2((2methylallyl)thio)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2methylprop2en1yl)sulfanyl)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(2METHYLPROP2ENYLSULFANYL)3PHENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
2(2METHYLPROP2ENYLTHIO)3PHENYLSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
332849635
CC(=C)CSC1=NC2=C(C(=O)N1C3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC27H28N2OSc119(2)18312628242214871120(22)1727(1594101627)23(24)25(30)29(26)21125361321h3581114H149101518H22H3
MFCD01807161
ZINC000002266982
ZINC02266982
ZINC2266982

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Available files

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