N-(2-morpholin-4-ium-4-ylethyl)-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-4-phenyl-piperazine-1-carbothioamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-4-phenylpiperazine-1-carbothioamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-4-phenyl-piperazine-1-carbothioamide Formula: C17H27N4OS+ MolecularWeight: 335.48748

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H26N4OS/c23-17(18-6-7-19-12-14-22-15-13-19)21-10-8-20(9-11-21)16-4-2-1-3-5-16/h1-5H,6-15H2,(H,18,23)/p+1