2-(4-methoxyphenyl)-4-[[4-(3-methylquinoxalin-2-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-(4-methoxyphenyl)-4-[[4-(3-methylquinoxalin-2-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Openeye Name: 2-(4-methoxyphenyl)-4-[[4-(3-methylquinoxalin-2-yl)piperazin-1-ium-1-yl]methyl]thiazole CAS Name: 2-(4-methoxyphenyl)-4-[[4-(3-methyl-2-quinoxalinyl)-1-piperazin-1-iumyl]methyl]thiazole IUPAC Name: 2-(4-methoxyphenyl)-4-[[4-(3-methylquinoxalin-2-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Traditional Name: 2-(4-methoxyphenyl)-4-[[4-(3-methylquinoxalin-2-yl)piperazin-1-ium-1-yl]methyl]thiazole Formula: C24H26N5OS+ MolecularWeight: 432.56114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1N3CC[NH+](CC3)CC4=CSC(=N4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1N3CC[NH+](CC3)CC4=CSC(=N4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C24H25N5OS/c1-17-23(27-22-6-4-3-5-21(22)25-17)29-13-11-28(12-14-29)15-19-16-31-24(26-19)18-7-9-20(30-2)10-8-18/h3-10,16H,11-15H2,1-2H3/p+1