Vitas-M small molecule compound
2-[benzyl(phenylacetyl)amino]-N-(2,4,6-trimethylphenyl)-1,2,3,4,4a,9,9a,10-octahydroanthracene-2-carboxamide
Catalog ID
STL439309
SMILES Cc1cc(C)c(c(c1)C)NC(=O)C1(CCC2C(C1)Cc1c(C2)cccc1)N(C(=O)Cc1ccccc1)Cc1ccccc1
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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 C39H42N2O2 MW 570.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H42N2O2/c1-27-20-28(2)37(29(3)21-27)40-38(43)39(19-18-34-23-32-16-10-11-17-33(32)24-35(34)25-39)41(26-31-14-8-5-9-15-31)36(42)22-30-12-6-4-7-13-30/h4-17,20-21,34-35H,18-19,22-26H2,1-3H3,(H,40,43)InChIKey
SDZGLDHACQERAK-UHFFFAOYSA-NSynonyms
2(BENZYL(2PHENYLACETYL)AMINO)N(246TRIMETHYLPHENYL)344A99A10HEXAHYDRO1HANTHRACENE2CARBOXAMIDE
2(benzyl(phenylacetyl)amino)N(246trimethylphenyl)12344a99a10octahydroanthracene2carboxamide
CC1=CC(=C(C(=C1)C)NC(=O)C2(CCC3CC4=CC=CC=C4CC3C2)N(CC5=CC=CC=C5)C(=O)CC6=CC=CC=C6)C
InChI=1SC39H42N2O2c1272028(2)37(29(3)2127)4038(43)39(19183423321610111733(32)2435(34)2539)41(2631148591531)36(42)2230126471330h41720213435H18192226H213H3(H4043)
MFCD29709716
ZINC000003764889
ZINC000254295878
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