(3,4-dichlorophenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanethione

Systemtic Name: (3,4-dichlorophenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanethione Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(3,4-dichlorophenyl)methanethione CAS Name: (3,4-dichlorophenyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanethione IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(3,4-dichlorophenyl)methanethione Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(3,4-dichlorophenyl)methanethione Formula: C18H19Cl2N2S+ MolecularWeight: 366.32786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=S)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=S)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H18Cl2N2S/c19-16-7-6-15(12-17(16)20)18(23)22-10-8-21(9-11-22)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2/p+1