Vitas-M small molecule compound
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
STL192514
SMILES Cc1ccc(c(c1)C)NC(=O)C1C2NC(=S)N(C1(C)Oc1c2cccc1)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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-16-13-14-20(17(2)15-16)27-24(30)22-23-19-11-7-8-12-21(19)31-26(22,3)29(25(32)28-23)18-9-5-4-6-10-18/h4-15,22-23H,1-3H3,(H,27,30)(H,28,32)InChIKey
GNYYBGWSEZCLCD-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)C2C3C4=CC=CC=C4OC2(N(C(=S)N3)C5=CC=CC=C5)C)C
InChI=1SC26H25N3O2Sc116131420(17(2)1516)2724(30)22231911781221(19)3126(223)29(25(32)2823)1895461018h4152223H13H3(H2730)(H2832)
MFCD22390740
N(24dimethylphenyl)2methyl3phenyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
ZINC000100034364
ZINC000100034368
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