4-(2-hydroxyethyl)-N-(3-methoxyphenyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-(2-hydroxyethyl)-N-(3-methoxyphenyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-(2-hydroxyethyl)-N-(3-methoxyphenyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-(2-hydroxyethyl)-N-(3-methoxyphenyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-(2-hydroxyethyl)-N-(3-methoxyphenyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-(2-hydroxyethyl)-N-(3-methoxyphenyl)piperazin-4-ium-1-carbothioamide Formula: C14H22N3O2S+ MolecularWeight: 296.40838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2S/c1-19-13-4-2-3-12(11-13)15-14(20)17-7-5-16(6-8-17)9-10-18/h2-4,11,18H,5-10H2,1H3,(H,15,20)/p+1