4-methyl-N-(3-methylphenyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-methyl-N-(3-methylphenyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-methyl-N-(m-tolyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-methyl-N-(3-methylphenyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-methyl-N-(3-methylphenyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-methyl-N-(m-tolyl)piperazin-4-ium-1-carbothioamide Formula: C13H20N3S+ MolecularWeight: 250.383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2CC[NH+](CC2)C

InChI

InChI=1S/C13H19N3S/c1-11-4-3-5-12(10-11)14-13(17)16-8-6-15(2)7-9-16/h3-5,10H,6-9H2,1-2H3,(H,14,17)/p+1