Vitas-M small molecule compound
(1S,5S)-N-{(2S)-1-[(4-methoxyphenyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Catalog ID
STL547260
SMILES COc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C24H30N4O4 MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O4/c1-15(2)22(23(30)25-18-7-9-19(32-3)10-8-18)26-24(31)27-12-16-11-17(14-27)20-5-4-6-21(29)28(20)13-16/h4-10,15-17,22H,11-14H2,1-3H3,(H,25,30)(H,26,31)/t16-,17+,22-/m0/s1InChIKey
FNMKEBJWHKYPMV-JKSBSHDWSA-NSynonyms
(1R5R)N((S)1((4methoxyphenyl)amino)3methyl1oxobutan2yl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxamide
(1S5S)N((2S)1((4methoxyphenyl)amino)3methyl1oxobutan2yl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
COc1ccc(cc1)NC(=O)(C@H)(C(C)C)NC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC24H30N4O4c115(2)22(23(30)25187919(323)10818)2624(31)2712161117(1427)2054621(29)28(20)1316h410151722H1114H213H3(H2530)(H2631)t1617+22m0s1
ZINC000002095207
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