4-cyclohexyl-N-phenethyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-cyclohexyl-N-phenethyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-cyclohexyl-N-phenethyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-cyclohexyl-N-phenethyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-cyclohexyl-N-phenethylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-cyclohexyl-N-phenethyl-piperazin-4-ium-1-carbothioamide Formula: C19H30N3S+ MolecularWeight: 332.5266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C19H29N3S/c23-19(20-12-11-17-7-3-1-4-8-17)22-15-13-21(14-16-22)18-9-5-2-6-10-18/h1,3-4,7-8,18H,2,5-6,9-16H2,(H,20,23)/p+1