Vitas-M small molecule compound
(1S,5S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Catalog ID
STL528092
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccc2c(c1)OCCO2
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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 C20H21N3O4 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4/c24-19-3-1-2-16-14-8-13(11-23(16)19)10-22(12-14)20(25)21-15-4-5-17-18(9-15)27-7-6-26-17/h1-5,9,13-14H,6-8,10-12H2,(H,21,25)/t13-,14+/m0/s1InChIKey
IIFGUEPMHCFGAV-UONOGXRCSA-NSynonyms
(1R5R)N(23dihydrobenzo(b)(14)dioxin6yl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxamide
(1S5S)N(23dihydro14benzodioxin6yl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
InChI=1SC20H21N3O4c24193121614813(1123(16)19)1022(1214)20(25)2115451718(915)27762617h1591314H681012H2(H2125)t1314+m0s1
MFCD03854062
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Nc1ccc2c(c1)OCCO2
ZINC000002096080
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