4-ethyl-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-ethyl-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carbothioamide Openeye Name: 4-ethyl-N-(p-tolylmethyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-ethyl-N-[(4-methylphenyl)methyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-ethyl-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carbothioamide Traditional Name: 4-ethyl-N-(4-methylbenzyl)piperazin-4-ium-1-carbothioamide Formula: C15H24N3S+ MolecularWeight: 278.43616

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=S)NCC2=CC=C(C=C2)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=S)NCC2=CC=C(C=C2)C

InChI

InChI=1S/C15H23N3S/c1-3-17-8-10-18(11-9-17)15(19)16-12-14-6-4-13(2)5-7-14/h4-7H,3,8-12H2,1-2H3,(H,16,19)/p+1