Vitas-M small molecule compound
(1S,5S)-N-{(2S)-1-[(4-fluorophenyl)amino]-1-oxo-3-phenylpropan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Catalog ID
STL537659
SMILES Fc1ccc(cc1)NC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
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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 C27H27FN4O3 MW 474.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN4O3/c28-21-9-11-22(12-10-21)29-26(34)23(14-18-5-2-1-3-6-18)30-27(35)31-15-19-13-20(17-31)24-7-4-8-25(33)32(24)16-19/h1-12,19-20,23H,13-17H2,(H,29,34)(H,30,35)/t19-,20+,23-/m0/s1InChIKey
HGDVFAXCFUISMF-MZKRTTBSSA-NSynonyms
(1R5R)N((S)1((4fluorophenyl)amino)1oxo3phenylpropan2yl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxamide
(1S5S)N((2S)1((4fluorophenyl)amino)1oxo3phenylpropan2yl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
Fc1ccc(cc1)NC(=O)(C@@H)(NC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
InChI=1SC27H27FN4O3c282191122(121021)2926(34)23(14185213618)3027(35)3115191320(1731)2474825(33)32(24)1619h112192023H1317H2(H2934)(H3035)t1920+23m0s1
ZINC000002093601
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