Vitas-M small molecule compound

2-[(2-hydroxy-4,5-dihydro-3H-1-benzazepin-3-yl)sulfanyl]-N-(pyridin-2-ylmethyl)acetamide

Catalog ID
STK632632
SMILES O=C(CSC1CCc2c(N=C1O)cccc2)NCc1ccccn1

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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 C18H19N3O2S MW 341.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2S/c22-17(20-11-14-6-3-4-10-19-14)12-24-16-9-8-13-5-1-2-7-15(13)21-18(16)23/h1-7,10,16H,8-9,11-12H2,(H,20,22)(H,21,23)
InChIKey
DXWYQWDDRFASRG-UHFFFAOYSA-N
Synonyms
1010874-11-9
1010874119
2((2hydroxy45dihydro3H1benzazepin3yl)sulfanyl)N(pyridin2ylmethyl)acetamide
2((2oxo1345tetrahydro1benzazepin3yl)sulfanyl)N(pyridin2ylmethyl)acetamide
C1CC2=CC=CC=C2NC(=O)C1SCC(=O)NCC3=CC=CC=N3
InChI=1SC18H19N3O2Sc2217(201114634101914)1224169813512715(13)2118(16)23h171016H891112H2(H2022)(H2123)
MFCD18159838
ZINC000012324467
ZINC000012324468

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Available files

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