Vitas-M small molecule compound
(1R,5S)-3-[(5-bromo-1H-indol-1-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL535599
SMILES Brc1ccc2c(c1)ccn2CC(=O)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 C21H20BrN3O2 MW 426.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN3O2/c22-17-4-5-18-15(9-17)6-7-23(18)13-21(27)24-10-14-8-16(12-24)19-2-1-3-20(26)25(19)11-14/h1-7,9,14,16H,8,10-13H2/t14-,16+/m0/s1InChIKey
CXCWNFRQHRYBNP-GOEBONIOSA-NSynonyms
(1R5S)3((5bromo1Hindol1yl)acetyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
(1R5S)3(2(5bromo1Hindol1yl)acetyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
Brc1ccc2c(c1)ccn2CC(=O)N1C(C@@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC21H20BrN3O2c2217451815(917)6723(18)1321(27)241014816(1224)1921320(26)25(19)1114h1791416H81013H2t1416+m0s1
MFCD12029642
ZINC000100791046
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