diethyl-[3-[(2-ethylphenyl)carbamothioyl-(furan-2-ylmethyl)amino]propyl]azanium

Systemtic Name: diethyl-[3-[(2-ethylphenyl)carbamothioyl-(furan-2-ylmethyl)amino]propyl]azanium Openeye Name: diethyl-[3-[(2-ethylphenyl)carbamothioyl-(2-furylmethyl)amino]propyl]ammonium CAS Name: diethyl-[3-[[(2-ethylanilino)-sulfanylidenemethyl]-(2-furanylmethyl)amino]propyl]ammonium IUPAC Name: diethyl-[3-[(2-ethylphenyl)carbamothioyl-(furan-2-ylmethyl)amino]propyl]azanium Traditional Name: diethyl-[3-[(2-ethylphenyl)thiocarbamoyl-(2-furfuryl)amino]propyl]ammonium Formula: C21H32N3OS+ MolecularWeight: 374.56328

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CCC[NH+](CC)CC)CC2=CC=CO2

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CCC[NH+](CC)CC)CC2=CC=CO2

InChI

InChI=1S/C21H31N3OS/c1-4-18-11-7-8-13-20(18)22-21(26)24(17-19-12-9-16-25-19)15-10-14-23(5-2)6-3/h7-9,11-13,16H,4-6,10,14-15,17H2,1-3H3,(H,22,26)/p+1