Vitas-M small molecule compound
ethyl [(3-cyclohexyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetate
Catalog ID
STK805515
SMILES CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)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 C27H34N2O3S MW 466.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O3S/c1-2-32-22(30)18-33-26-28-24-21-14-8-7-11-19(21)17-27(15-9-4-10-16-27)23(24)25(31)29(26)20-12-5-3-6-13-20/h7-8,11,14,20H,2-6,9-10,12-13,15-18H2,1H3InChIKey
JELSFACBOWVDQX-UHFFFAOYSA-NSynonyms
312585-20-9312585209
CCOC(=O)CSC1=NC2=C(C(=O)N1C3CCCCC3)C4(CCCCC4)CC5=CC=CC=C52
ethyl((3cyclohexyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetate
ethyl2((3cyclohexyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetate
ETHYL2(3CYCLOHEXYL4OXOSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YLTHIO)ACETATE
ETHYL2(3CYCLOHEXYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETATE
InChI=1SC27H34N2O3Sc123222(30)18332628242114871119(21)1727(1594101627)23(24)25(31)29(26)20125361320h78111420H2691012131518H21H3
MFCD00688824
ZINC000001823722
ZINC01823722
ZINC1823722
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