N-(2-chlorophenyl)-4-(diphenylmethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-(2-chlorophenyl)-4-(diphenylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-benzhydryl-N-(2-chlorophenyl)piperazin-4-ium-1-carbothioamide CAS Name: N-(2-chlorophenyl)-4-(diphenylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-benzhydryl-N-(2-chlorophenyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-benzhydryl-N-(2-chlorophenyl)piperazin-4-ium-1-carbothioamide Formula: C24H25ClN3S+ MolecularWeight: 422.9934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC4=CC=CC=C4Cl

InChI

InChI=1S/C24H24ClN3S/c25-21-13-7-8-14-22(21)26-24(29)28-17-15-27(16-18-28)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-14,23H,15-18H2,(H,26,29)/p+1