Vitas-M small molecule compound

(1S,5R)-N-(2,5-dimethoxyphenyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide

Catalog ID
STL548856
SMILES COc1ccc(c(c1)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)OC

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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 C20H23N3O4 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O4/c1-26-15-6-7-18(27-2)16(9-15)21-20(25)22-10-13-8-14(12-22)17-4-3-5-19(24)23(17)11-13/h3-7,9,13-14H,8,10-12H2,1-2H3,(H,21,25)/t13-,14+/m0/s1
InChIKey
UGPQOWDCQRDGPP-UONOGXRCSA-N
Synonyms

(1R5R)N(25dimethoxyphenyl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxamide
(1S5R)N(25dimethoxyphenyl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
COc1ccc(c(c1)NC(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)OC
InChI=1SC20H23N3O4c126156718(272)16(915)2120(25)221013814(1222)1743519(24)23(17)1113h3791314H81012H212H3(H2125)t1314+m0s1
ZINC000104312440

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Available files

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