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

Systemtic Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(naphthalen-1-ylmethylidene)-1,3-thiazol-4-one Openeye Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(1-naphthylmethylene)thiazol-4-one CAS Name: (5E)-2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-5-(1-naphthalenylmethylidene)-4-thiazolone IUPAC Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(naphthalen-1-ylmethylidene)-1,3-thiazol-4-one Traditional Name: (5E)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(1-naphthylmethylene)-2-thiazolin-4-one Formula: C20H22N3O2S+ MolecularWeight: 368.47258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=NC(=O)C(=CC3=CC=CC4=CC=CC=C43)S2

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=NC(=O)/C(=C\C3=CC=CC4=CC=CC=C43)/S2

InChI

InChI=1S/C20H21N3O2S/c24-13-12-22-8-10-23(11-9-22)20-21-19(25)18(26-20)14-16-6-3-5-15-4-1-2-7-17(15)16/h1-7,14,24H,8-13H2/p+1/b18-14+