Vitas-M small molecule compound
N-(4-chlorophenyl)-2,8-dimethyl-3-(2-methylphenyl)-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL166016
SMILES Cc1ccc2c(c1)C1NC(=S)N(C(O2)(C1C(=O)Nc1ccc(cc1)Cl)C)c1ccccc1C
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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/c1-15-8-13-21-19(14-15)23-22(24(31)28-18-11-9-17(27)10-12-18)26(3,32-21)30(25(33)29-23)20-7-5-4-6-16(20)2/h4-14,22-23H,1-3H3,(H,28,31)(H,29,33)InChIKey
XGGRJRKHOTWZPC-UHFFFAOYSA-NSynonyms
1023527-24-31023527243
CC1=CC2=C(C=C1)OC3(C(C2NC(=S)N3C4=CC=CC=C4C)C(=O)NC5=CC=C(C=C5)Cl)C
InChI=1SC26H24ClN3O2Sc1158132119(1415)2322(24(31)281811917(27)101218)26(33221)30(25(33)2923)20754616(20)2h4142223H13H3(H2831)(H2933)
MFCD15086195
N(4chlorophenyl)28dimethyl3(2methylphenyl)4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
ZINC000002963215
ZINC000245245879
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