Vitas-M small molecule compound
ethyl [(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetate
Catalog ID
STK830691
SMILES CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3
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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 C27H28N2O3S MW 460.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3S/c1-2-32-22(30)18-33-26-28-24-21-13-7-6-12-20(21)16-27(14-8-9-15-27)23(24)25(31)29(26)17-19-10-4-3-5-11-19/h3-7,10-13H,2,8-9,14-18H2,1H3InChIKey
ZKWIDXZVHLDPDA-UHFFFAOYSA-NSynonyms
300717-94-6300717946
CCOC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)C4(CCCC4)CC5=CC=CC=C52
ethyl((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetate
ethyl2((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)acetate
ETHYL2(3BENZYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETATE
InChI=1SC27H28N2O3Sc123222(30)18332628242113761220(21)1627(14891527)23(24)25(31)29(26)1719104351119h371013H2891418H21H3
MFCD00323374
ZINC000001793851
ZINC01793851
ZINC1793851
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