4-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-1,3-thiazole

Systemtic Name: 4-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-1,3-thiazole Openeye Name: 4-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-thiazole CAS Name: 4-(3,4-dimethoxyphenyl)-2-(1-piperazin-4-iumyl)thiazole IUPAC Name: 4-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-1,3-thiazole Traditional Name: 4-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-thiazole Formula: C15H20N3O2S+ MolecularWeight: 306.4032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)N3CC[NH2+]CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)N3CC[NH2+]CC3)OC

InChI

InChI=1S/C15H19N3O2S/c1-19-13-4-3-11(9-14(13)20-2)12-10-21-15(17-12)18-7-5-16-6-8-18/h3-4,9-10,16H,5-8H2,1-2H3/p+1