N-(2-ethylphenyl)-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-ium-1-yl]acetamide Formula: C24H29N4OS+ MolecularWeight: 421.57826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4OS/c1-2-19-8-6-7-11-22(19)26-23(29)17-28-14-12-27(13-15-28)16-21-18-30-24(25-21)20-9-4-3-5-10-20/h3-11,18H,2,12-17H2,1H3,(H,26,29)/p+1