dimethyl-[2-[[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]carbothioylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]carbothioylamino]ethyl]azanium Openeye Name: 2-[[4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-carbothioyl]amino]ethyl-dimethyl-ammonium CAS Name: dimethyl-[2-[[[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]-sulfanylidenemethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-carbothioyl]amino]ethyl]azanium Traditional Name: 2-[[4-(4-isopropylbenzyl)piperazin-4-ium-1-carbothioyl]amino]ethyl-dimethyl-ammonium Formula: C19H34N4S+2 MolecularWeight: 350.56506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=S)NCC[NH+](C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=S)NCC[NH+](C)C

InChI

InChI=1S/C19H32N4S/c1-16(2)18-7-5-17(6-8-18)15-22-11-13-23(14-12-22)19(24)20-9-10-21(3)4/h5-8,16H,9-15H2,1-4H3,(H,20,24)/p+2