N-(4-bromophenyl)-2-[4-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[4-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[4-[4-(3-methoxyphenyl)thiazol-2-yl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[4-[4-(3-methoxyphenyl)-2-thiazolyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[4-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[4-[4-(3-methoxyphenyl)thiazol-2-yl]piperazin-1-ium-1-yl]acetamide Formula: C22H24BrN4O2S+ MolecularWeight: 488.42056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CSC(=N2)N3CC[NH+](CC3)CC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2=CSC(=N2)N3CC[NH+](CC3)CC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H23BrN4O2S/c1-29-19-4-2-3-16(13-19)20-15-30-22(25-20)27-11-9-26(10-12-27)14-21(28)24-18-7-5-17(23)6-8-18/h2-8,13,15H,9-12,14H2,1H3,(H,24,28)/p+1