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

Systemtic Name: 2-(2,3-dimethoxyphenyl)-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Openeye Name: 2-(2,3-dimethoxyphenyl)-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]thiazole CAS Name: 2-(2,3-dimethoxyphenyl)-4-[[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]methyl]thiazole IUPAC Name: 2-(2,3-dimethoxyphenyl)-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Traditional Name: 2-(2,3-dimethoxyphenyl)-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]thiazole Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=CSC(=N3)C4=C(C(=CC=C4)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=CSC(=N3)C4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C23H27N3O3S/c1-27-19-7-4-6-18(14-19)26-12-10-25(11-13-26)15-17-16-30-23(24-17)20-8-5-9-21(28-2)22(20)29-3/h4-9,14,16H,10-13,15H2,1-3H3/p+1