4-[[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-pyridin-2-yl-1,3-thiazole

Systemtic Name: 4-[[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-pyridin-2-yl-1,3-thiazole Openeye Name: 4-[[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(2-pyridyl)thiazole CAS Name: 4-[[4-(4-propylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-(2-pyridinyl)thiazole IUPAC Name: 4-[[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-pyridin-2-yl-1,3-thiazole Traditional Name: 4-[[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(2-pyridyl)thiazole Formula: C22H27N4O2S2+ MolecularWeight: 443.60538

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CSC(=N3)C4=CC=CC=N4

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CSC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C22H26N4O2S2/c1-2-5-18-7-9-20(10-8-18)30(27,28)26-14-12-25(13-15-26)16-19-17-29-22(24-19)21-6-3-4-11-23-21/h3-4,6-11,17H,2,5,12-16H2,1H3/p+1