Vitas-M small molecule compound

2-bromo-N-(4-{[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]sulfonyl}phenyl)benzamide

Catalog ID
STL527711
SMILES O=C(c1ccccc1Br)Nc1ccc(cc1)S(=O)(=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 C24H22BrN3O4S MW 528.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN3O4S/c25-21-5-2-1-4-20(21)24(30)26-18-8-10-19(11-9-18)33(31,32)27-13-16-12-17(15-27)22-6-3-7-23(29)28(22)14-16/h1-11,16-17H,12-15H2,(H,26,30)/t16-,17+/m0/s1
InChIKey
MJZWWJDRONHDIB-DLBZAZTESA-N
Synonyms

2bromoN(4(((1R5R)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)sulfonyl)phenyl)benzamide
2bromoN(4(((1S5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)sulfonyl)phenyl)benzamide
InChI=1SC24H22BrN3O4Sc2521521420(21)24(30)261881019(11918)33(3132)2713161217(1527)2263723(29)28(22)1416h1111617H1215H2(H2630)t1617+m0s1
MFCD03661377
O=C(c1ccccc1Br)Nc1ccc(cc1)S(=O)(=O)N1C(C@@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ZINC000100750408

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Available files

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