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

Systemtic Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C16H23N5OS+2 MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C16H21N5OS/c1-13-18-19-16(23-13)17-15(22)12-21-9-7-20(8-10-21)11-14-5-3-2-4-6-14/h2-6H,7-12H2,1H3,(H,17,19,22)/p+2