N-tert-butyl-2-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[(4-phenylthiazol-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(4-phenyl-2-thiazolyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[(4-phenylthiazol-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C20H30N4OS+2 MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H28N4OS/c1-20(2,3)22-18(25)13-23-9-11-24(12-10-23)14-19-21-17(15-26-19)16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3,(H,22,25)/p+2