4-[[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methyl]-2-phenyl-1,3-thiazole

Systemtic Name: 4-[[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methyl]-2-phenyl-1,3-thiazole Openeye Name: 4-[[4-(2-furylmethyl)piperazin-4-ium-1-yl]methyl]-2-phenyl-thiazole CAS Name: 4-[[4-(2-furanylmethyl)-1-piperazin-4-iumyl]methyl]-2-phenylthiazole IUPAC Name: 4-[[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methyl]-2-phenyl-1,3-thiazole Traditional Name: 4-[[4-(2-furfuryl)piperazin-4-ium-1-yl]methyl]-2-phenyl-thiazole Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CO2)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CO2)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H21N3OS/c1-2-5-16(6-3-1)19-20-17(15-24-19)13-21-8-10-22(11-9-21)14-18-7-4-12-23-18/h1-7,12,15H,8-11,13-14H2/p+1