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

Systemtic Name: butyl-[3-[furan-2-ylmethyl-[(3-methylphenyl)carbamothioyl]amino]propyl]-methyl-azanium Openeye Name: butyl-[3-[2-furylmethyl(m-tolylcarbamothioyl)amino]propyl]-methyl-ammonium CAS Name: butyl-[3-[2-furanylmethyl-[(3-methylanilino)-sulfanylidenemethyl]amino]propyl]-methylammonium IUPAC Name: butyl-[3-[furan-2-ylmethyl-[(3-methylphenyl)carbamothioyl]amino]propyl]-methylazanium Traditional Name: butyl-[3-[2-furfuryl(m-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(=C2)C

Isomeric SMILES

CCCC[NH+](C)CCCN(CC1=CC=CO1)C(=S)NC2=CC=CC(=C2)C

InChI

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