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

Systemtic Name: 4-cyclohexyl-N-phenyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-cyclohexyl-N-phenyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-cyclohexyl-N-phenyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-cyclohexyl-N-phenylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-cyclohexyl-N-phenyl-piperazin-4-ium-1-carbothioamide Formula: C17H26N3S+ MolecularWeight: 304.47344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C17H25N3S/c21-17(18-15-7-3-1-4-8-15)20-13-11-19(12-14-20)16-9-5-2-6-10-16/h1,3-4,7-8,16H,2,5-6,9-14H2,(H,18,21)/p+1