N-(3,5-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide Openeye Name: N-(3,5-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide CAS Name: N-(3,5-dimethoxyphenyl)-4-(2-hydroxyethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: N-(3,5-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide Traditional Name: N-(3,5-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide Formula: C15H24N3O3S+ MolecularWeight: 326.43436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)N2CC[NH+](CC2)CCO)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)N2CC[NH+](CC2)CCO)OC

InChI

InChI=1S/C15H23N3O3S/c1-20-13-9-12(10-14(11-13)21-2)16-15(22)18-5-3-17(4-6-18)7-8-19/h9-11,19H,3-8H2,1-2H3,(H,16,22)/p+1