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1-[(4-bromanylthiophen-2-yl)methyl]-4-(2,3-dimethylphenyl)piperazin-1-ium

1-[(4-bromanylthiophen-2-yl)methyl]-4-(2,3-dimethylphenyl)piperazin-1-ium

Systemtic Name:1-[(4-bromanylthiophen-2-yl)methyl]-4-(2,3-dimethylphenyl)piperazin-1-ium
Openeye Name:1-[(4-bromo-2-thienyl)methyl]-4-(2,3-dimethylphenyl)piperazin-1-ium
CAS Name:1-[(4-bromo-2-thiophenyl)methyl]-4-(2,3-dimethylphenyl)piperazin-1-ium
IUPAC Name:1-[(4-bromothiophen-2-yl)methyl]-4-(2,3-dimethylphenyl)piperazin-1-ium
Traditional Name:1-[(4-bromo-2-thienyl)methyl]-4-(2,3-dimethylphenyl)piperazin-1-ium
Formula: C17H22BrN2S+
MolecularWeight: 366.33898
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CC(=CS3)Br)C


Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CC(=CS3)Br)C


InChI

InChI=1S/C17H21BrN2S/c1-13-4-3-5-17(14(13)2)20-8-6-19(7-9-20)11-16-10-15(18)12-21-16/h3-5,10,12H,6-9,11H2,1-2H3/p+1


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