(5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(pyridin-2-ylmethylidene)-1,3-thiazol-4-one

Systemtic Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(pyridin-2-ylmethylidene)-1,3-thiazol-4-one Openeye Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(2-pyridylmethylene)thiazol-4-one CAS Name: (5E)-2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-5-(2-pyridinylmethylidene)-4-thiazolone IUPAC Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(pyridin-2-ylmethylidene)-1,3-thiazol-4-one Traditional Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(2-pyridylmethylene)-2-thiazolin-4-one Formula: C15H19N4O2S+ MolecularWeight: 319.40196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=NC(=O)C(=CC3=CC=CC=N3)S2

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=NC(=O)/C(=C\C3=CC=CC=N3)/S2

InChI

InChI=1S/C15H18N4O2S/c20-10-9-18-5-7-19(8-6-18)15-17-14(21)13(22-15)11-12-3-1-2-4-16-12/h1-4,11,20H,5-10H2/p+1/b13-11+