Vitas-M small molecule compound
ethyl {[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetate
Catalog ID
STK551674
SMILES CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C25H26N2O4S MW 450.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O4S/c1-2-30-20(28)16-32-24-26-22-19-10-4-3-8-17(19)14-25(11-5-6-12-25)21(22)23(29)27(24)15-18-9-7-13-31-18/h3-4,7-10,13H,2,5-6,11-12,14-16H2,1H3InChIKey
YFPORMNNMITWNZ-UHFFFAOYSA-NSynonyms
799829-94-0799829940
CCOC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCC4)CC5=CC=CC=C52
ethyl((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetate
ethyl2((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)acetate
ETHYL2(3(FURAN2YLMETHYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETATE
InChI=1SC25H26N2O4Sc123020(28)1632242622191043817(19)1425(11561225)21(22)23(29)27(24)151897133118h3471013H25611121416H21H3
MFCD03683999
ZINC000002245435
ZINC02245435
ZINC2245435
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