Vitas-M small molecule compound

2-methyl-N-{6-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridin-3-yl}prop-2-enamide

Catalog ID
STL536379
SMILES O=C(C(=C)C)Nc1ccc(nc1)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 C20H22N4O2 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2/c1-13(2)20(26)22-16-6-7-18(21-9-16)23-10-14-8-15(12-23)17-4-3-5-19(25)24(17)11-14/h3-7,9,14-15H,1,8,10-12H2,2H3,(H,22,26)/t14-,15+/m0/s1
InChIKey
HANVSQFUKNDXRD-LSDHHAIUSA-N
Synonyms

2methylN(6((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)pyridin3yl)prop2enamide
InChI=1SC20H22N4O2c113(2)20(26)22166718(21916)231014815(1223)1743519(25)24(17)1114h3791415H181012H22H3(H2226)t1415+m0s1
N(6((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)pyridin3yl)methacrylamide
O=C(C(=C)C)Nc1ccc(nc1)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ZINC000062001844

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Available files

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