(5-bromanylthiophen-2-yl)methyl-methyl-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-methyl-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-methyl-[2-[4-(m-tolyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-methyl-[2-[4-(3-methylphenyl)-1-piperazinyl]-2-oxoethyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-methyl-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-[2-keto-2-[4-(m-tolyl)piperazino]ethyl]-methyl-ammonium Formula: C19H25BrN3OS+ MolecularWeight: 423.3903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C[NH+](C)CC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C[NH+](C)CC3=CC=C(S3)Br

InChI

InChI=1S/C19H24BrN3OS/c1-15-4-3-5-16(12-15)22-8-10-23(11-9-22)19(24)14-21(2)13-17-6-7-18(20)25-17/h3-7,12H,8-11,13-14H2,1-2H3/p+1