Vitas-M small molecule compound
(2R,6R)-N-tert-butyl-2-methyl-4-oxo-3-(prop-2-en-1-yl)-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxamide
Catalog ID
STL527579
SMILES C=CCN1C(=O)C(C(=O)NC(C)(C)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 C20H26N2O3 MW 342.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O3/c1-6-11-22-18(24)16(17(23)21-19(2,3)4)14-12-20(22,5)25-15-10-8-7-9-13(14)15/h6-10,14,16H,1,11-12H2,2-5H3,(H,21,23)/t14-,16?,20-/m1/s1InChIKey
DHNCWQIFLXBPEU-RBKVJPRLSA-NSynonyms
(2R6R)Ntertbutyl2methyl4oxo3(prop2en1yl)3456tetrahydro2H26methano13benzoxazocine5carboxamide
(2R6S)3allylN(tertbutyl)2methyl4oxo3456tetrahydro2H26methanobenzo(g)(13)oxazocine5carboxamide
C=CCN1C(=O)C(C(=O)NC(C)(C)C)(C@H)2C(C@@)1(C)Oc1c2cccc1
InChI=1SC20H26N2O3c16112218(24)16(17(23)2119(23)4)141220(225)25151087913(14)15h6101416H11112H225H3(H2123)t1416?20m1s1
MFCD03660303
ZINC000100632506
ZINC000100749498
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