3-[[(4-chlorophenyl)methyl-(pyridin-2-ylmethyl)carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4-chlorophenyl)methyl-(pyridin-2-ylmethyl)carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(4-chlorophenyl)methyl-(2-pyridylmethyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(4-chlorophenyl)methyl-(2-pyridinylmethyl)amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4-chlorophenyl)methyl-(pyridin-2-ylmethyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(4-chlorobenzyl)-(2-pyridylmethyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C19H26ClN4S+ MolecularWeight: 377.95454

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N(CC1=CC=C(C=C1)Cl)CC2=CC=CC=N2

Isomeric SMILES

C[NH+](C)CCCNC(=S)N(CC1=CC=C(C=C1)Cl)CC2=CC=CC=N2

InChI

InChI=1S/C19H25ClN4S/c1-23(2)13-5-12-22-19(25)24(15-18-6-3-4-11-21-18)14-16-7-9-17(20)10-8-16/h3-4,6-11H,5,12-15H2,1-2H3,(H,22,25)/p+1