(4-methylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanethione

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanethione Openeye Name: (4-methylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanethione CAS Name: (4-methyl-1-piperazin-4-iumyl)-(3,4,5-trimethoxyphenyl)methanethione IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanethione Traditional Name: (4-methylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanethione Formula: C15H23N2O3S+ MolecularWeight: 311.41972

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C15H22N2O3S/c1-16-5-7-17(8-6-16)15(21)11-9-12(18-2)14(20-4)13(10-11)19-3/h9-10H,5-8H2,1-4H3/p+1