Vitas-M small molecule compound
8-chloro-N-(2,4-dimethylphenyl)-2-methyl-3-phenyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL192532
SMILES Clc1ccc2c(c1)C1NC(=S)N(C(O2)(C1C(=O)Nc1ccc(cc1C)C)C)c1ccccc1
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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 C26H24ClN3O2S MW 478.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O2S/c1-15-9-11-20(16(2)13-15)28-24(31)22-23-19-14-17(27)10-12-21(19)32-26(22,3)30(25(33)29-23)18-7-5-4-6-8-18/h4-14,22-23H,1-3H3,(H,28,31)(H,29,33)InChIKey
VVGDLXLTJNPDEN-UHFFFAOYSA-NSynonyms
1024054-77-01024054770
8chloroN(24dimethylphenyl)2methyl3phenyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
CC1=CC(=C(C=C1)NC(=O)C2C3C4=C(C=CC(=C4)Cl)OC2(N(C(=S)N3)C5=CC=CC=C5)C)C
InChI=1SC26H24ClN3O2Sc11591120(16(2)1315)2824(31)2223191417(27)101221(19)3226(223)30(25(33)2923)187546818h4142223H13H3(H2831)(H2933)
MFCD15086046
ZINC000100031179
ZINC000100031182
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