Vitas-M small molecule compound
(1S,5S)-N-[(2S)-1-{[2-(4-methoxyphenyl)ethyl]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
STL543008
SMILES COc1ccc(cc1)CCNC(=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 C26H34N4O4 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N4O4/c1-17(2)24(25(32)27-12-11-18-7-9-21(34-3)10-8-18)28-26(33)29-14-19-13-20(16-29)22-5-4-6-23(31)30(22)15-19/h4-10,17,19-20,24H,11-16H2,1-3H3,(H,27,32)(H,28,33)/t19-,20+,24-/m0/s1InChIKey
CNNVRXBXSZOMLX-ROKPMTFOSA-NSynonyms
(1R5R)N((S)1((4methoxyphenethyl)amino)3methyl1oxobutan2yl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxamide
(1S5S)N((2S)1((2(4methoxyphenyl)ethyl)amino)3methyl1oxobutan2yl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
COc1ccc(cc1)CCNC(=O)(C@H)(C(C)C)NC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC26H34N4O4c117(2)24(25(32)271211187921(343)10818)2826(33)2914191320(1629)2254623(31)30(22)1519h41017192024H1116H213H3(H2732)(H2833)t1920+24m0s1
ZINC000225408122
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