Vitas-M small molecule compound

4-chloro-N-(4-{[(1R,5R)-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
STL527959
SMILES Clc1ccc(cc1)C(=O)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 C24H22ClN3O4S MW 483.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O4S/c25-19-6-4-17(5-7-19)24(30)26-20-8-10-21(11-9-20)33(31,32)27-13-16-12-18(15-27)22-2-1-3-23(29)28(22)14-16/h1-11,16,18H,12-15H2,(H,26,30)/t16-,18+/m0/s1
InChIKey
PGATYHPIMXMJLH-FUHWJXTLSA-N
Synonyms
1212445-95-8
1212445958
16398302
4chloro~(N)(4(((1~(R)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)sulfonyl)phenyl)benzamide
4chloroN(4(((1R5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)sulfonyl)phenyl)benzamide
4chloroN(4(((1R5R)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)sulfonyl)phenyl)benzamide
Clc1ccc(cc1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC24H22ClN3O4Sc25196417(5719)24(30)262081021(11920)33(3132)2713161218(1527)2221323(29)28(22)1416h1111618H1215H2(H2630)t1618+m0s1
MFCD03661502
ZINC000008882872
ZINC8882872

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.