dimethyl-[3-[(phenylmethyl)-[(phenylmethyl)carbamothioyl]amino]propyl]azanium

Systemtic Name: dimethyl-[3-[(phenylmethyl)-[(phenylmethyl)carbamothioyl]amino]propyl]azanium Openeye Name: 3-[benzyl(benzylcarbamothioyl)amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[(phenylmethyl)-[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: 3-[benzyl(benzylcarbamothioyl)amino]propyl-dimethylazanium Traditional Name: 3-[benzyl(benzylthiocarbamoyl)amino]propyl-dimethyl-ammonium Formula: C20H28N3S+ MolecularWeight: 342.52142

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(CC1=CC=CC=C1)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CCCN(CC1=CC=CC=C1)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C20H27N3S/c1-22(2)14-9-15-23(17-19-12-7-4-8-13-19)20(24)21-16-18-10-5-3-6-11-18/h3-8,10-13H,9,14-17H2,1-2H3,(H,21,24)/p+1