Vitas-M small molecule compound
3-[(1-methyl-1H-indazol-3-yl)carbonyl]-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL511701
SMILES O=C(c1nn(c2c1cccc2)C)N1CC2CC(C1)c1n(C2)c(=O)c(cc1)[N+](=O)[O-]
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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 C20H19N5O4 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O4/c1-22-16-5-3-2-4-14(16)18(21-22)20(27)23-9-12-8-13(11-23)15-6-7-17(25(28)29)19(26)24(15)10-12/h2-7,12-13H,8-11H2,1H3InChIKey
OMAYVLKBSWCNHC-UHFFFAOYSA-NSynonyms
(1R5S)3(1methyl1Hindazole3carbonyl)9nitro3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
11(1methylindazole3carbonyl)5nitro711diazatricyclo(7310^(27))trideca24dien6one
135638045
3((1methyl1Hindazol3yl)carbonyl)9nitro123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC20H19N5O4c12216532414(16)18(2122)20(27)23912813(1123)156717(25(28)29)19(26)24(15)1012h271213H811H21H3
MFCD31751778
O=C(c1nn(c2c1cccc2)C)N1C(C@@H)2C(C@@H)(C1)c1n(C2)c(=O)c(cc1)(N+)(=O)(O)
ZINC001547212414
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