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

Systemtic Name: dimethyl-[3-[(3-methylphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]propyl]azanium Openeye Name: dimethyl-[3-[m-tolylcarbamothioyl(2-thienylmethyl)amino]propyl]ammonium CAS Name: dimethyl-[3-[[(3-methylanilino)-sulfanylidenemethyl]-(thiophen-2-ylmethyl)amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(3-methylphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]propyl]azanium Traditional Name: dimethyl-[3-[m-tolylthiocarbamoyl(2-thenyl)amino]propyl]ammonium Formula: C18H26N3S2+ MolecularWeight: 348.54914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC=CS2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC=CS2

InChI

InChI=1S/C18H25N3S2/c1-15-7-4-8-16(13-15)19-18(22)21(11-6-10-20(2)3)14-17-9-5-12-23-17/h4-5,7-9,12-13H,6,10-11,14H2,1-3H3,(H,19,22)/p+1