[4-[(3-methylphenyl)methoxy]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanethione

Systemtic Name: [4-[(3-methylphenyl)methoxy]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanethione Openeye Name: (4-methylpiperazin-4-ium-1-yl)-[4-(m-tolylmethoxy)phenyl]methanethione CAS Name: [4-[(3-methylphenyl)methoxy]phenyl]-(4-methyl-1-piperazin-4-iumyl)methanethione IUPAC Name: [4-[(3-methylphenyl)methoxy]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanethione Traditional Name: [4-(3-methylbenzyl)oxyphenyl]-(4-methylpiperazin-4-ium-1-yl)methanethione Formula: C20H25N2OS+ MolecularWeight: 341.4903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=S)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=S)N3CC[NH+](CC3)C

InChI

InChI=1S/C20H24N2OS/c1-16-4-3-5-17(14-16)15-23-19-8-6-18(7-9-19)20(24)22-12-10-21(2)11-13-22/h3-9,14H,10-13,15H2,1-2H3/p+1