(2S)-2-(4-methylpiperazin-4-ium-1-yl)-2-(4-propan-2-ylphenyl)ethanethioamide

Systemtic Name: (2S)-2-(4-methylpiperazin-4-ium-1-yl)-2-(4-propan-2-ylphenyl)ethanethioamide Openeye Name: (2S)-2-(4-isopropylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)thioacetamide CAS Name: (2S)-2-(4-methyl-1-piperazin-4-iumyl)-2-(4-propan-2-ylphenyl)ethanethioamide IUPAC Name: (2S)-2-(4-methylpiperazin-4-ium-1-yl)-2-(4-propan-2-ylphenyl)ethanethioamide Traditional Name: (2S)-2-(4-methylpiperazin-4-ium-1-yl)-2-p-cumenyl-thioacetamide Formula: C16H26N3S+ MolecularWeight: 292.46274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C(=S)N)N2CC[NH+](CC2)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@@H](C(=S)N)N2CC[NH+](CC2)C

InChI

InChI=1S/C16H25N3S/c1-12(2)13-4-6-14(7-5-13)15(16(17)20)19-10-8-18(3)9-11-19/h4-7,12,15H,8-11H2,1-3H3,(H2,17,20)/p+1/t15-/m0/s1