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(4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methylthiophen-2-yl)methyl]azanium

(4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name:(4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methylthiophen-2-yl)methyl]azanium
Openeye Name:(4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methyl-2-thienyl)methyl]ammonium
CAS Name:(4-dimethylaminophenyl)methyl-[3-(1-imidazolyl)propyl]-[(3-methyl-2-thiophenyl)methyl]ammonium
IUPAC Name:(4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methylthiophen-2-yl)methyl]azanium
Traditional Name:[4-(dimethylamino)benzyl]-(3-imidazol-1-ylpropyl)-[(3-methyl-2-thienyl)methyl]ammonium
Formula: C21H29N4S+
MolecularWeight: 369.54676
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](CCCN2C=CN=C2)CC3=CC=C(C=C3)N(C)C


Isomeric SMILES

CC1=C(SC=C1)C[NH+](CCCN2C=CN=C2)CC3=CC=C(C=C3)N(C)C


InChI

InChI=1S/C21H28N4S/c1-18-9-14-26-21(18)16-25(12-4-11-24-13-10-22-17-24)15-19-5-7-20(8-6-19)23(2)3/h5-10,13-14,17H,4,11-12,15-16H2,1-3H3/p+1


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