Vitas-M small molecule compound
2-{[(4-hydroxy-6H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)methyl]sulfanyl}-3-phenylquinazolin-4(3H)-one
Catalog ID
STK562188
SMILES Oc1nc(CSc2nc3ccccc3c(=O)n2c2ccccc2)nc2c1C1(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 C32H28N4O2S MW 532.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N4O2S/c37-29-27-28(23-14-6-5-11-21(23)19-32(27)17-9-2-10-18-32)34-26(35-29)20-39-31-33-25-16-8-7-15-24(25)30(38)36(31)22-12-3-1-4-13-22/h1,3-8,11-16H,2,9-10,17-20H2,(H,34,35,37)InChIKey
WTWPOOORTLJQCD-UHFFFAOYSA-NSynonyms
371144-50-22(((4hydroxy6Hspiro(benzo(h)quinazoline51cyclohexan)2yl)methyl)sulfanyl)3phenylquinazolin4(3H)one
2((4OXO3PHENYLQUINAZOLIN2YL)SULFANYLMETHYL)SPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
371144502
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N=C(N4)CSC5=NC6=CC=CC=C6C(=O)N5C7=CC=CC=C7
InChI=1SC32H28N4O2Sc37292728(2314651121(23)1932(27)1792101832)3426(3529)203931332516871524(25)30(38)36(31)22123141322h1381116H29101720H2(H343537)
MFCD03803296
ZINC000001789604
ZINC01789604
ZINC1789604
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