4-(2-hydroxyethyl)-N-(4-phenoxyphenyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-(2-hydroxyethyl)-N-(4-phenoxyphenyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-(2-hydroxyethyl)-N-(4-phenoxyphenyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-(2-hydroxyethyl)-N-(4-phenoxyphenyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-(2-hydroxyethyl)-N-(4-phenoxyphenyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-(2-hydroxyethyl)-N-(4-phenoxyphenyl)piperazin-4-ium-1-carbothioamide Formula: C19H24N3O2S+ MolecularWeight: 358.47776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCO)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O2S/c23-15-14-21-10-12-22(13-11-21)19(25)20-16-6-8-18(9-7-16)24-17-4-2-1-3-5-17/h1-9,23H,10-15H2,(H,20,25)/p+1