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

Systemtic Name: N-cyclopropyl-4-(diphenylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-benzhydryl-N-cyclopropyl-piperazin-4-ium-1-carbothioamide CAS Name: N-cyclopropyl-4-(diphenylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-benzhydryl-N-cyclopropylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-benzhydryl-N-cyclopropyl-piperazin-4-ium-1-carbothioamide Formula: C21H26N3S+ MolecularWeight: 352.51624

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=S)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3S/c25-21(22-19-11-12-19)24-15-13-23(14-16-24)20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,19-20H,11-16H2,(H,22,25)/p+1