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

Systemtic Name: 2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazin-1-iumyl]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-pyrrolidinophenyl)acetamide Formula: C21H30N5OS+ MolecularWeight: 400.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CC1=NC(=CS1)CN2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C21H29N5OS/c1-17-22-19(16-28-17)14-24-10-12-25(13-11-24)15-21(27)23-18-4-6-20(7-5-18)26-8-2-3-9-26/h4-7,16H,2-3,8-15H2,1H3,(H,23,27)/p+1