Vitas-M small molecule compound
3-(4-bromophenyl)-1-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium
Catalog ID
STL264390
SMILES Clc1ccc(cc1)[n+]1cc(n2c1CCCCC2)c1ccc(cc1)Br
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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 C20H19BrClN2 MW 402.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrClN2/c21-16-7-5-15(6-8-16)19-14-24(18-11-9-17(22)10-12-18)20-4-2-1-3-13-23(19)20/h5-12,14H,1-4,13H2/q+1InChIKey
PQYULVVNFBIDOD-UHFFFAOYSA-NSynonyms
3(4BROMOPHENYL)1(4CHLOROPHENYL)5H6H7H8H9HIMIDAZO(12A)AZAPERHYDROEPINE
3(4bromophenyl)1(4chlorophenyl)6789tetrahydro5Himidazo(12a)azepin1ium
3(4bromophenyl)1(4chlorophenyl)6789tetrahydro5Himidazo(12a)azepin1iumbromide
3(4bromophenyl)1(4chlorophenyl)6789tetrahydro5Himidazo(12a)azepin4ium
C1CCC2=(N+)(CC1)C(=CN2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Br
Clc1ccc(cc1)(n+)1cc(n2c1CCCCC2)c1ccc(cc1)Br
Clc1ccc(cc1)(n+)1cc(n2c1CCCCC2)c1ccc(cc1)Br(Br)
InChI=1SC20H19BrClN2c21167515(6816)191424(1811917(22)101218)2042131323(19)20h51214H1413H2q+1
MFCD02996542
ZINC000013686399
ZINC13686399
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