N-(4-oxidanylidene-1,3-thiazol-2-yl)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(4-oxidanylidene-1,3-thiazol-2-yl)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(4-oxothiazol-2-yl)acetamide CAS Name: N-(4-oxo-2-thiazolyl)-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(4-oxo-1,3-thiazol-2-yl)acetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(4-keto-2-thiazolin-2-yl)acetamide Formula: C16H22N4O2S+2 MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(=O)NC3=NC(=O)CS3

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(=O)NC3=NC(=O)CS3

InChI

InChI=1S/C16H20N4O2S/c21-14(17-16-18-15(22)12-23-16)11-20-8-6-19(7-9-20)10-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,17,18,21,22)/p+2