[1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-methyl-(3-methylbutyl)azanium

Systemtic Name: [1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-methyl-(3-methylbutyl)azanium Openeye Name: [1-[(2-ethylphenyl)carbamothioyl]-4-piperidyl]-isopentyl-methyl-ammonium CAS Name: [1-[(2-ethylanilino)-sulfanylidenemethyl]-4-piperidinyl]-methyl-(3-methylbutyl)ammonium IUPAC Name: [1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-methyl-(3-methylbutyl)azanium Traditional Name: [1-[(2-ethylphenyl)thiocarbamoyl]-4-piperidyl]-isoamyl-methyl-ammonium Formula: C20H34N3S+ MolecularWeight: 348.56906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCC(CC2)[NH+](C)CCC(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCC(CC2)[NH+](C)CCC(C)C

InChI

InChI=1S/C20H33N3S/c1-5-17-8-6-7-9-19(17)21-20(24)23-14-11-18(12-15-23)22(4)13-10-16(2)3/h6-9,16,18H,5,10-15H2,1-4H3,(H,21,24)/p+1