Vitas-M small molecule compound
N-(2,4-dimethylphenyl)-10-ethoxy-2-methyl-3-(2-methylphenyl)-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL192470
SMILES CCOc1cccc2c1OC1(C)C(C2NC(=O)N1c1ccccc1C)C(=O)Nc1ccc(cc1C)C
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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 C29H31N3O4 MW 485.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O4/c1-6-35-23-13-9-11-20-25-24(27(33)30-21-15-14-17(2)16-19(21)4)29(5,36-26(20)23)32(28(34)31-25)22-12-8-7-10-18(22)3/h7-16,24-25H,6H2,1-5H3,(H,30,33)(H,31,34)InChIKey
CQXDYLCXALMMDS-UHFFFAOYSA-NSynonyms
1795029-51-41795029514
CCOC1=CC=CC2=C1OC3(C(C2NC(=O)N3C4=CC=CC=C4C)C(=O)NC5=C(C=C(C=C5)C)C)C
InChI=1SC29H31N3O4c16352313911202524(27(33)3021151417(2)1619(21)4)29(53626(20)23)32(28(34)3125)2212871018(22)3h7162425H6H215H3(H3033)(H3134)
MFCD22390709
N(24dimethylphenyl)10ethoxy2methyl3(2methylphenyl)4oxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
ZINC000216474333
ZINC000216474425
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