N-[5-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[5-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[5-[(3,4-dichlorophenyl)methyl]thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[5-[(3,4-dichlorophenyl)methyl]-2-thiazolyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[5-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[5-(3,4-dichlorobenzyl)thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C17H20Cl2N3OS+ MolecularWeight: 385.3312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=NC=C(S2)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=NC=C(S2)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H19Cl2N3OS/c18-14-5-4-12(9-15(14)19)8-13-10-20-17(24-13)21-16(23)11-22-6-2-1-3-7-22/h4-5,9-10H,1-3,6-8,11H2,(H,20,21,23)/p+1