Vitas-M small molecule compound
2-{[(4-hydroxy-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)methyl]sulfanyl}-3-(2-methylphenyl)quinazolin-4(3H)-one
Catalog ID
STL148009
SMILES Cc1ccccc1n1c(SCc2nc(O)c3c(n2)c2ccccc2CC23CCCC2)nc2c(c1=O)cccc2
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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/c1-20-10-2-7-15-25(20)36-30(38)23-13-5-6-14-24(23)33-31(36)39-19-26-34-28-22-12-4-3-11-21(22)18-32(16-8-9-17-32)27(28)29(37)35-26/h2-7,10-15H,8-9,16-19H2,1H3,(H,34,35,37)InChIKey
NWOAUXCCHVLVKI-UHFFFAOYSA-NSynonyms
385385-57-92(((4hydroxy6Hspiro(benzo(h)quinazoline51cyclopentan)2yl)methyl)sulfanyl)3(2methylphenyl)quinazolin4(3H)one
2((3(2METHYLPHENYL)4OXOQUINAZOLIN2YL)SULFANYLMETHYL)SPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
385385579
CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=O)C5=C(N4)C6=CC=CC=C6CC57CCCC7
InChI=1SC32H28N4O2Sc12010271525(20)3630(38)2313561424(23)3331(36)39192634282212431121(22)1832(16891732)27(28)29(37)3526h271015H891619H21H3(H343537)
MFCD03803034
ZINC000001788297
ZINC01788297
ZINC1788297
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