2-[(3-bromophenyl)carbamothioyl-(phenylmethyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3-bromophenyl)carbamothioyl-(phenylmethyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[benzyl-[(3-bromophenyl)carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3-bromoanilino)-sulfanylidenemethyl]-(phenylmethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[benzyl-[(3-bromophenyl)carbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[benzyl-[(3-bromophenyl)thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C18H23BrN3S+ MolecularWeight: 393.36432

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(CC1=CC=CC=C1)C(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+](C)CCN(CC1=CC=CC=C1)C(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H22BrN3S/c1-21(2)11-12-22(14-15-7-4-3-5-8-15)18(23)20-17-10-6-9-16(19)13-17/h3-10,13H,11-12,14H2,1-2H3,(H,20,23)/p+1