Vitas-M small molecule compound

3-[(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL448412
SMILES O=C(c1nnn(c1C)c1ccccc1)N1CC2CC(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 C21H21N5O2 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2/c1-14-20(22-23-26(14)17-6-3-2-4-7-17)21(28)24-11-15-10-16(13-24)18-8-5-9-19(27)25(18)12-15/h2-9,15-16H,10-13H2,1H3
InChIKey
DPBXJSGIOCCFHS-UHFFFAOYSA-N
Synonyms

3((5methyl1phenyl1H123triazol4yl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
CC1=C(N=NN1C2=CC=CC=C2)C(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4
InChI=1SC21H21N5O2c11420(222326(14)176324717)21(28)2411151016(1324)1885919(27)25(18)1215h291516H1013H21H3
MFCD07397453
ZINC000004942655

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Available files

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