3-(butylamino)-3-phenyl-1-piperidin-1-ium-1-yl-prop-2-ene-1-thione

Systemtic Name: 3-(butylamino)-3-phenyl-1-piperidin-1-ium-1-yl-prop-2-ene-1-thione Openeye Name: 3-(butylamino)-3-phenyl-1-piperidin-1-ium-1-yl-prop-2-ene-1-thione CAS Name: 3-(butylamino)-3-phenyl-1-(1-piperidin-1-iumyl)-2-propene-1-thione IUPAC Name: 3-(butylamino)-3-phenyl-1-piperidin-1-ium-1-ylprop-2-ene-1-thione Traditional Name: 3-(butylamino)-3-phenyl-1-piperidin-1-ium-1-yl-prop-2-ene-1-thione Formula: C18H27N2S+ MolecularWeight: 303.48538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=CC(=S)[NH+]1CCCCC1)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=CC(=S)[NH+]1CCCCC1)C2=CC=CC=C2

InChI

InChI=1S/C18H26N2S/c1-2-3-12-19-17(16-10-6-4-7-11-16)15-18(21)20-13-8-5-9-14-20/h4,6-7,10-11,15,19H,2-3,5,8-9,12-14H2,1H3/p+1