2,3-diphenyl-5-[4-(phenylmethyl)piperazin-1-ium-1-ylidene]-1,2,4-thiadiazole

Systemtic Name: 2,3-diphenyl-5-[4-(phenylmethyl)piperazin-1-ium-1-ylidene]-1,2,4-thiadiazole Openeye Name: 5-(4-benzylpiperazin-1-ium-1-ylidene)-2,3-diphenyl-1,2,4-thiadiazole CAS Name: 2,3-diphenyl-5-[4-(phenylmethyl)-1-piperazin-1-iumylidene]-1,2,4-thiadiazole IUPAC Name: 5-(4-benzylpiperazin-1-ium-1-ylidene)-2,3-diphenyl-1,2,4-thiadiazole Traditional Name: 5-(4-benzylpiperazin-1-ium-1-ylidene)-2,3-diphenyl-1,2,4-thiadiazole Formula: C25H25N4S+ MolecularWeight: 413.5578

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C2N=C(N(S2)C3=CC=CC=C3)C4=CC=CC=C4)CCN1CC5=CC=CC=C5

Isomeric SMILES

C1C[N+](=C2N=C(N(S2)C3=CC=CC=C3)C4=CC=CC=C4)CCN1CC5=CC=CC=C5

InChI

InChI=1S/C25H25N4S/c1-4-10-21(11-5-1)20-27-16-18-28(19-17-27)25-26-24(22-12-6-2-7-13-22)29(30-25)23-14-8-3-9-15-23/h1-15H,16-20H2/q+1