4-[2-(4-chloranylphenoxy)ethyl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-[2-(4-chloranylphenoxy)ethyl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-[2-(4-chlorophenoxy)ethyl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-[2-(4-chlorophenoxy)ethyl]-N-cyclopropyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-[2-(4-chlorophenoxy)ethyl]-N-cyclopropylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-[2-(4-chlorophenoxy)ethyl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide Formula: C16H23ClN3OS+ MolecularWeight: 340.89132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC1NC(=S)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H22ClN3OS/c17-13-1-5-15(6-2-13)21-12-11-19-7-9-20(10-8-19)16(22)18-14-3-4-14/h1-2,5-6,14H,3-4,7-12H2,(H,18,22)/p+1