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

Systemtic Name: 2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)acetamide CAS Name: 2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-1-iumyl]-N-(2,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)acetamide Traditional Name: 2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)acetamide Formula: C19H25ClN3O3S+ MolecularWeight: 410.9381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCN(CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCN(CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C19H24ClN3O3S/c1-25-14-3-5-17(26-2)16(11-14)21-19(24)13-23-9-7-22(8-10-23)12-15-4-6-18(20)27-15/h3-6,11H,7-10,12-13H2,1-2H3,(H,21,24)/p+1