Vitas-M small molecule compound
ethyl {[3-(4-methoxybenzyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetate
Catalog ID
STK067884
SMILES CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccc(cc1)OC)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 C29H32N2O4S MW 504.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O4S/c1-3-35-24(32)19-36-28-30-26-23-10-6-5-9-21(23)17-29(15-7-4-8-16-29)25(26)27(33)31(28)18-20-11-13-22(34-2)14-12-20/h5-6,9-14H,3-4,7-8,15-19H2,1-2H3InChIKey
QGOYPWNOYKWRRA-UHFFFAOYSA-NSynonyms
337495-54-2337495542
CCOC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=C(C=C3)OC)C4(CCCCC4)CC5=CC=CC=C52
CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccc(cc1)OC)CCCCC3
ETHYL((3(4METHOXYBENZYL)4OXO46DIHYDRO3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXAN)2YL)SULFANYL)ACETATE
ethyl2((3(4methoxybenzyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetate
ETHYL2(3((4METHOXYPHENYL)METHYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETATE
InChI=1SC29H32N2O4Sc133524(32)1936283026231065921(23)1729(157481629)25(26)27(33)31(28)1820111322(342)141220h56914H34781519H212H3
MFCD01559298
STK067884
ZINC000002181964
ZINC02181964
ZINC2181964
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