3,4,5-trimethoxy-N-(4-methylpiperazin-4-ium-1-yl)carbothioyl-benzamide

Systemtic Name: 3,4,5-trimethoxy-N-(4-methylpiperazin-4-ium-1-yl)carbothioyl-benzamide Openeye Name: 3,4,5-trimethoxy-N-(4-methylpiperazin-4-ium-1-carbothioyl)benzamide CAS Name: 3,4,5-trimethoxy-N-[(4-methyl-1-piperazin-4-iumyl)-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-(4-methylpiperazin-4-ium-1-carbothioyl)benzamide Traditional Name: 3,4,5-trimethoxy-N-(4-methylpiperazin-4-ium-1-carbothioyl)benzamide Formula: C16H24N3O4S+ MolecularWeight: 354.44446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O4S/c1-18-5-7-19(8-6-18)16(24)17-15(20)11-9-12(21-2)14(23-4)13(10-11)22-3/h9-10H,5-8H2,1-4H3,(H,17,20,24)/p+1