Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]-L-prolinamide

Catalog ID
STL534819
SMILES O=C([C@@H]1CCCN1C(=O)[C@H]1NCc2c(C1)cccc2)Nc1ccc2c(c1)OCCO2

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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 C23H25N3O4 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O4/c27-22(25-17-7-8-20-21(13-17)30-11-10-29-20)19-6-3-9-26(19)23(28)18-12-15-4-1-2-5-16(15)14-24-18/h1-2,4-5,7-8,13,18-19,24H,3,6,9-12,14H2,(H,25,27)/t18-,19-/m0/s1
InChIKey
BQPDFKRISBYVCV-OALUTQOASA-N
Synonyms

(2~(S))~(N)(23dihydro14benzodioxin6yl)1((3~(S))1234tetrahydroisoquinoline3carbonyl)pyrrolidine2carboxamide
(S)N(23dihydrobenzo(b)(14)dioxin6yl)1((S)1234tetrahydroisoquinoline3carbonyl)pyrrolidine2carboxamidehydrochloride
11876667
InChI=1SC23H25N3O4c2722(2517782021(1317)3011102920)1963926(19)23(28)181215412516(15)142418h12457813181924H3691214H2(H2527)t1819m0s1
N(23dihydro14benzodioxin6yl)1((3S)1234tetrahydroisoquinolin3ylcarbonyl)Lprolinamide
O=C((C@@H)1CCCN1C(=O)(C@H)1NCc2c(C1)cccc2)Nc1ccc2c(c1)OCCO2Cl
ZINC000035485176
ZINC35485176

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Available files

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