butan-2-yl-[1-[(4-ethoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-azanium

Systemtic Name: butan-2-yl-[1-[(4-ethoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-azanium Openeye Name: [1-[(4-ethoxyphenyl)carbamothioyl]-4-piperidyl]-methyl-sec-butyl-ammonium CAS Name: butan-2-yl-[1-[(4-ethoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-methylammonium IUPAC Name: butan-2-yl-[1-[(4-ethoxyphenyl)carbamothioyl]piperidin-4-yl]-methylazanium Traditional Name: methyl-[1-(p-phenetylthiocarbamoyl)-4-piperidyl]-sec-butyl-ammonium Formula: C19H32N3OS+ MolecularWeight: 350.54188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+](C)C1CCN(CC1)C(=S)NC2=CC=C(C=C2)OCC

Isomeric SMILES

CCC(C)[NH+](C)C1CCN(CC1)C(=S)NC2=CC=C(C=C2)OCC

InChI

InChI=1S/C19H31N3OS/c1-5-15(3)21(4)17-11-13-22(14-12-17)19(24)20-16-7-9-18(10-8-16)23-6-2/h7-10,15,17H,5-6,11-14H2,1-4H3,(H,20,24)/p+1