Vitas-M small molecule compound
(2R,6R)-2-methyl-N-(3-methylphenyl)-4-oxo-3-(prop-2-en-1-yl)-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxamide
Catalog ID
STL527626
SMILES C=CCN1C(=O)C(C(=O)Nc2cccc(c2)C)[C@H]2C[C@@]1(C)Oc1c2cccc1
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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 C23H24N2O3 MW 376.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O3/c1-4-12-25-22(27)20(21(26)24-16-9-7-8-15(2)13-16)18-14-23(25,3)28-19-11-6-5-10-17(18)19/h4-11,13,18,20H,1,12,14H2,2-3H3,(H,24,26)/t18-,20?,23-/m1/s1InChIKey
IBEMTEADOXCYPF-ZBOFDPRTSA-NSynonyms
(2R6R)2methylN(3methylphenyl)4oxo3(prop2en1yl)3456tetrahydro2H26methano13benzoxazocine5carboxamide
(2R6S)3allyl2methyl4oxoN(mtolyl)3456tetrahydro2H26methanobenzo(g)(13)oxazocine5carboxamide
C=CCN1C(=O)C(C(=O)Nc2cccc(c2)C)(C@H)2C(C@@)1(C)Oc1c2cccc1
InChI=1SC23H24N2O3c14122522(27)20(21(26)241697815(2)1316)181423(253)281911651017(18)19h411131820H11214H223H3(H2426)t1820?23m1s1
MFCD03660117
ZINC000002137288
ZINC000002137289
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