Vitas-M small molecule compound
N-(2,4-dimethylphenyl)-10-methoxy-2-methyl-3-(4-methylphenyl)-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL192480
SMILES COc1cccc2c1OC1(C)N(C(=O)NC2C1C(=O)Nc1ccc(cc1C)C)c1ccc(cc1)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 C28H29N3O4 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4/c1-16-9-12-19(13-10-16)31-27(33)30-24-20-7-6-8-22(34-5)25(20)35-28(31,4)23(24)26(32)29-21-14-11-17(2)15-18(21)3/h6-15,23-24H,1-5H3,(H,29,32)(H,30,33)InChIKey
WMMHWAPTRZORIC-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C(=O)NC3C(C2(OC4=C3C=CC=C4OC)C)C(=O)NC5=C(C=C(C=C5)C)C
InChI=1SC28H29N3O4c11691219(131016)3127(33)30242076822(345)25(20)3528(314)23(24)26(32)2921141117(2)1518(21)3h6152324H15H3(H2932)(H3033)
MFCD22390719
N(24dimethylphenyl)10methoxy2methyl3(4methylphenyl)4oxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
ZINC000100032646
ZINC000106937726
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