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

Systemtic Name: 3-[(3-methoxyphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(3-methoxyphenyl)carbamothioyl-(2-thienylmethyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[(3-methoxyanilino)-sulfanylidenemethyl]-(thiophen-2-ylmethyl)amino]propyl-dimethylammonium IUPAC Name: 3-[(3-methoxyphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]propyl-dimethylazanium Traditional Name: 3-[(3-methoxyphenyl)thiocarbamoyl-(2-thenyl)amino]propyl-dimethyl-ammonium Formula: C18H26N3OS2+ MolecularWeight: 364.54854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(CC1=CC=CS1)C(=S)NC2=CC(=CC=C2)OC

Isomeric SMILES

C[NH+](C)CCCN(CC1=CC=CS1)C(=S)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C18H25N3OS2/c1-20(2)10-6-11-21(14-17-9-5-12-24-17)18(23)19-15-7-4-8-16(13-15)22-3/h4-5,7-9,12-13H,6,10-11,14H2,1-3H3,(H,19,23)/p+1