4-cyclohexyl-N-(furan-2-ylmethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-cyclohexyl-N-(furan-2-ylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-cyclohexyl-N-(2-furylmethyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-cyclohexyl-N-(2-furanylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-cyclohexyl-N-(furan-2-ylmethyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-cyclohexyl-N-(2-furfuryl)piperazin-4-ium-1-carbothioamide Formula: C16H26N3OS+ MolecularWeight: 308.46214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NCC3=CC=CO3

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NCC3=CC=CO3

InChI

InChI=1S/C16H25N3OS/c21-16(17-13-15-7-4-12-20-15)19-10-8-18(9-11-19)14-5-2-1-3-6-14/h4,7,12,14H,1-3,5-6,8-11,13H2,(H,17,21)/p+1