Vitas-M small molecule compound

3-benzyl-2-{[(4-hydroxy-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)methyl]sulfanyl}quinazolin-4(3H)-one

Catalog ID
STK561265
SMILES O=c1c2ccccc2nc(n1Cc1ccccc1)SCc1nc(O)c2c(n1)c1ccccc1CC12CCCC1

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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 C32H28N4O2S MW 532.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N4O2S/c37-29-27-28(23-13-5-4-12-22(23)18-32(27)16-8-9-17-32)34-26(35-29)20-39-31-33-25-15-7-6-14-24(25)30(38)36(31)19-21-10-2-1-3-11-21/h1-7,10-15H,8-9,16-20H2,(H,34,35,37)
InChIKey
MAUARKSFMWHCFJ-UHFFFAOYSA-N
Synonyms
370574-75-7
2((3BENZYL4OXOQUINAZOLIN2YL)SULFANYLMETHYL)SPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
370574757
3benzyl2(((4hydroxy6Hspiro(benzo(h)quinazoline51cyclopentan)2yl)methyl)sulfanyl)quinazolin4(3H)one
C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N=C(N4)CSC5=NC6=CC=CC=C6C(=O)N5CC7=CC=CC=C7
InChI=1SC32H28N4O2Sc37292728(2313541222(23)1832(27)16891732)3426(3529)203931332515761424(25)30(38)36(31)1921102131121h171015H891620H2(H343537)
MFCD03814529
ZINC000002316527
ZINC2316527

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Available files

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