1-(3-methylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea

Systemtic Name: 1-(3-methylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(m-tolyl)thiourea CAS Name: 1-(3-methylphenyl)-3-(4-methyl-1-piperazin-4-iumyl)thiourea IUPAC Name: 1-(3-methylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(m-tolyl)thiourea Formula: C13H21N4S+ MolecularWeight: 265.39764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NN2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NN2CC[NH+](CC2)C

InChI

InChI=1S/C13H20N4S/c1-11-4-3-5-12(10-11)14-13(18)15-17-8-6-16(2)7-9-17/h3-5,10H,6-9H2,1-2H3,(H2,14,15,18)/p+1