1-[(5-ethanoylthiophen-3-yl)methyl]-N-[3-(1,3-thiazol-4-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(5-ethanoylthiophen-3-yl)methyl]-N-[3-(1,3-thiazol-4-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(5-acetyl-3-thienyl)methyl]-N-(3-thiazol-4-ylphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(5-acetyl-3-thiophenyl)methyl]-N-[3-(4-thiazolyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(5-acetylthiophen-3-yl)methyl]-N-[3-(1,3-thiazol-4-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(5-acetyl-3-thienyl)methyl]-N-(3-thiazol-4-ylphenyl)piperidin-1-ium-4-carboxamide Formula: C22H24N3O2S2+ MolecularWeight: 426.57486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CSC=N4

Isomeric SMILES

CC(=O)C1=CC(=CS1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CSC=N4

InChI

InChI=1S/C22H23N3O2S2/c1-15(26)21-9-16(12-29-21)11-25-7-5-17(6-8-25)22(27)24-19-4-2-3-18(10-19)20-13-28-14-23-20/h2-4,9-10,12-14,17H,5-8,11H2,1H3,(H,24,27)/p+1