butyl-[3-[furan-2-ylmethyl-[(2-methylphenyl)carbamothioyl]amino]propyl]-methyl-azanium

Systemtic Name: butyl-[3-[furan-2-ylmethyl-[(2-methylphenyl)carbamothioyl]amino]propyl]-methyl-azanium Openeye Name: butyl-[3-[2-furylmethyl(o-tolylcarbamothioyl)amino]propyl]-methyl-ammonium CAS Name: butyl-[3-[2-furanylmethyl-[(2-methylanilino)-sulfanylidenemethyl]amino]propyl]-methylammonium IUPAC Name: butyl-[3-[furan-2-ylmethyl-[(2-methylphenyl)carbamothioyl]amino]propyl]-methylazanium Traditional Name: butyl-[3-[2-furfuryl(o-tolylthiocarbamoyl)amino]propyl]-methyl-ammonium Formula: C21H32N3OS+ MolecularWeight: 374.56328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CCCN(CC1=CC=CO1)C(=S)NC2=CC=CC=C2C

Isomeric SMILES

CCCC[NH+](C)CCCN(CC1=CC=CO1)C(=S)NC2=CC=CC=C2C

InChI

InChI=1S/C21H31N3OS/c1-4-5-13-23(3)14-9-15-24(17-19-11-8-16-25-19)21(26)22-20-12-7-6-10-18(20)2/h6-8,10-12,16H,4-5,9,13-15,17H2,1-3H3,(H,22,26)/p+1