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

Systemtic Name: 2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-morpholinophenyl)acetamide CAS Name: 2-[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazin-1-iumyl]-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-ium-1-yl]-N-(4-morpholinophenyl)acetamide Formula: C21H30N5O2S+ MolecularWeight: 416.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=NC(=CS1)CN2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H29N5O2S/c1-17-22-19(16-29-17)14-24-6-8-25(9-7-24)15-21(27)23-18-2-4-20(5-3-18)26-10-12-28-13-11-26/h2-5,16H,6-15H2,1H3,(H,23,27)/p+1