4-(diphenylmethyl)-N-ethyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-(diphenylmethyl)-N-ethyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-benzhydryl-N-ethyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-(diphenylmethyl)-N-ethyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-benzhydryl-N-ethylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-benzhydryl-N-ethyl-piperazin-4-ium-1-carbothioamide Formula: C20H26N3S+ MolecularWeight: 340.50554

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCNC(=S)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3S/c1-2-21-20(24)23-15-13-22(14-16-23)19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19H,2,13-16H2,1H3,(H,21,24)/p+1