(2-methoxyphenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanethione

Systemtic Name: (2-methoxyphenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanethione Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(2-methoxyphenyl)methanethione CAS Name: (2-methoxyphenyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanethione IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(2-methoxyphenyl)methanethione Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(2-methoxyphenyl)methanethione Formula: C19H23N2OS+ MolecularWeight: 327.46372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=S)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=S)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N2OS/c1-22-18-10-6-5-9-17(18)19(23)21-13-11-20(12-14-21)15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3/p+1