2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C22H27N5OS+2 MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5OS/c1-17-24-25-22(29-17)23-20(28)16-26-12-14-27(15-13-26)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,21H,12-16H2,1H3,(H,23,25,28)/p+2