Vitas-M small molecule compound

2-[(4-chlorophenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-phenylethanone

Catalog ID
STL271981
SMILES Clc1ccc(cc1)N(C1=NCCCCC1)CC(=O)c1ccccc1

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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 C20H21ClN2O MW 340.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O/c21-17-10-12-18(13-11-17)23(20-9-5-2-6-14-22-20)15-19(24)16-7-3-1-4-8-16/h1,3-4,7-8,10-13H,2,5-6,9,14-15H2
InChIKey
OGARLLUTZAWTFM-UHFFFAOYSA-N
Synonyms

2((4chlorophenyl)(3456tetrahydro2Hazepin7yl)amino)1phenylethanone
2((4CHLOROPHENYL)23DIHYDRO4H5H6HAZEPIN7YLAMINO)1PHENYLETHAN1ONE
2(4chloroN(3456tetrahydro2Hazepin7yl)anilino)1phenylethanone
C1CCC(=NCC1)N(CC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI=1SC20H21ClN2Oc2117101218(131117)23(209526142220)1519(24)167314816h134781013H25691415H2
MFCD06736308
ZINC000008435929
ZINC8435929

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Available files

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