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

Systemtic Name: N-(2-chlorophenyl)-2-[4-[(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-(2-methyl-4-phenyl-thiazole-5-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[(2-methyl-4-phenyl-5-thiazolyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-(2-methyl-4-phenyl-1,3-thiazole-5-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-(2-methyl-4-phenyl-thiazole-5-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C23H24ClN4O2S+ MolecularWeight: 455.98026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C(S1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H23ClN4O2S/c1-16-25-21(17-7-3-2-4-8-17)22(31-16)23(30)28-13-11-27(12-14-28)15-20(29)26-19-10-6-5-9-18(19)24/h2-10H,11-15H2,1H3,(H,26,29)/p+1