Vitas-M small molecule compound
ethyl {[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetate
Catalog ID
STK835938
SMILES CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C26H28N2O4S MW 464.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O4S/c1-2-31-21(29)17-33-25-27-23-20-11-5-4-9-18(20)15-26(12-6-3-7-13-26)22(23)24(30)28(25)16-19-10-8-14-32-19/h4-5,8-11,14H,2-3,6-7,12-13,15-17H2,1H3InChIKey
AJLLNAIIWWVIIT-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCCC4)CC5=CC=CC=C52
ethyl((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetate
ethyl2((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetate
ETHYL2(3(FURAN2YLMETHYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETATE
InChI=1SC26H28N2O4Sc123121(29)1733252723201154918(20)1526(126371326)22(23)24(30)28(25)1619108143219h4581114H236712131517H21H3
MFCD02240380
ZINC000001261421
ZINC01261421
ZINC1261421
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