1-[4-[(2-phenylazanyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[(2-phenylazanyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(2-anilinothiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[(2-anilino-4-thiazolyl)methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[(2-anilino-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[(2-anilinothiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethanone Formula: C16H21N4OS+ MolecularWeight: 317.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC2=CSC(=N2)NC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC2=CSC(=N2)NC3=CC=CC=C3

InChI

InChI=1S/C16H20N4OS/c1-13(21)20-9-7-19(8-10-20)11-15-12-22-16(18-15)17-14-5-3-2-4-6-14/h2-6,12H,7-11H2,1H3,(H,17,18)/p+1