N-[[(2S)-oxolan-2-yl]methyl]-4-phenyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-[[(2S)-oxolan-2-yl]methyl]-4-phenyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-phenyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-carbothioamide CAS Name: N-[[(2S)-2-oxolanyl]methyl]-4-phenyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-[[(2S)-oxolan-2-yl]methyl]-4-phenylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-phenyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-carbothioamide Formula: C16H24N3OS+ MolecularWeight: 306.44626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)N2CC[NH+](CC2)C3=CC=CC=C3

Isomeric SMILES

C1C[C@H](OC1)CNC(=S)N2CC[NH+](CC2)C3=CC=CC=C3

InChI

InChI=1S/C16H23N3OS/c21-16(17-13-15-7-4-12-20-15)19-10-8-18(9-11-19)14-5-2-1-3-6-14/h1-3,5-6,15H,4,7-13H2,(H,17,21)/p+1/t15-/m0/s1