Vitas-M small molecule compound

(1S,5R)-3-{2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL543349
SMILES O=c1cccc2n1C[C@H]1CN(C[C@@H]2C1)C(=O)C(Oc1ccc(cc1)C1CC1(Cl)Cl)(C)C

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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 C24H26Cl2N2O3 MW 461.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26Cl2N2O3/c1-23(2,31-18-8-6-16(7-9-18)19-11-24(19,25)26)22(30)27-12-15-10-17(14-27)20-4-3-5-21(29)28(20)13-15/h3-9,15,17,19H,10-14H2,1-2H3/t15-,17+,19?/m0/s1
InChIKey
JEQBFUQAGACCEC-NADDXPSSSA-N
Synonyms

(1R5S)3(2(4(22dichlorocyclopropyl)phenoxy)2methylpropanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(2(4(22dichlorocyclopropyl)phenoxy)2methylpropanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC24H26Cl2N2O3c123(231188616(7918)191124(1925)26)22(30)2712151017(1427)2043521(29)28(20)1315h39151719H1014H212H3t1517+19?m0s1
O=c1cccc2n1C(C@H)1CN(C(C@@H)2C1)C(=O)C(Oc1ccc(cc1)C1CC1(Cl)Cl)(C)C
ZINC000225425186
ZINC000225425223

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Available files

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