3-[(4-methoxyphenyl)methylcarbamothioyl-(thiophen-2-ylmethyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-methoxyphenyl)methylcarbamothioyl-(thiophen-2-ylmethyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-methoxyphenyl)methylcarbamothioyl-(2-thienylmethyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]-(thiophen-2-ylmethyl)amino]propyl-dimethylammonium IUPAC Name: 3-[(4-methoxyphenyl)methylcarbamothioyl-(thiophen-2-ylmethyl)amino]propyl-dimethylazanium Traditional Name: dimethyl-[3-[p-anisylthiocarbamoyl(2-thenyl)amino]propyl]ammonium Formula: C19H28N3OS2+ MolecularWeight: 378.57512

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(CC1=CC=CS1)C(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

C[NH+](C)CCCN(CC1=CC=CS1)C(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H27N3OS2/c1-21(2)11-5-12-22(15-18-6-4-13-25-18)19(24)20-14-16-7-9-17(23-3)10-8-16/h4,6-10,13H,5,11-12,14-15H2,1-3H3,(H,20,24)/p+1