Vitas-M small molecule compound
(1S,5S)-N-[(2S)-3-methyl-1-oxo-1-{[4-(trifluoromethoxy)phenyl]amino}butan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Catalog ID
STL540429
SMILES CC([C@@H](C(=O)Nc1ccc(cc1)OC(F)(F)F)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)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 C24H27F3N4O4 MW 492.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27F3N4O4/c1-14(2)21(22(33)28-17-6-8-18(9-7-17)35-24(25,26)27)29-23(34)30-11-15-10-16(13-30)19-4-3-5-20(32)31(19)12-15/h3-9,14-16,21H,10-13H2,1-2H3,(H,28,33)(H,29,34)/t15-,16+,21-/m0/s1InChIKey
RKIAKJHEHLEGBC-MRUHUIDDSA-NSynonyms
(1R5R)N((S)3methyl1oxo1((4(trifluoromethoxy)phenyl)amino)butan2yl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxamide
(1S5S)N((2S)3methyl1oxo1((4(trifluoromethoxy)phenyl)amino)butan2yl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
CC((C@@H)(C(=O)Nc1ccc(cc1)OC(F)(F)F)NC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)C
InChI=1SC24H27F3N4O4c114(2)21(22(33)28176818(9717)3524(2526)27)2923(34)3011151016(1330)1943520(32)31(19)1215h39141621H1013H212H3(H2833)(H2934)t1516+21m0s1
ZINC000002093827
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