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

Systemtic Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]-N-thiazol-2-yl-acetamide CAS Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazin-1-iumyl]-N-(2-thiazolyl)acetamide IUPAC Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[4-(2,5-dimethoxybenzyl)piperazin-1-ium-1-yl]-N-thiazol-2-yl-acetamide Formula: C18H25N4O3S+ MolecularWeight: 377.4811

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CC[NH+](CC2)CC(=O)NC3=NC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CC[NH+](CC2)CC(=O)NC3=NC=CS3

InChI

InChI=1S/C18H24N4O3S/c1-24-15-3-4-16(25-2)14(11-15)12-21-6-8-22(9-7-21)13-17(23)20-18-19-5-10-26-18/h3-5,10-11H,6-9,12-13H2,1-2H3,(H,19,20,23)/p+1