(5Z)-2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-5-[(3-hydroxyphenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: (5Z)-2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-5-[(3-hydroxyphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5Z)-2-(4-benzhydrylpiperazin-4-ium-1-yl)-5-[(3-hydroxyphenyl)methylene]thiazol-4-one CAS Name: (5Z)-2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-5-[(3-hydroxyphenyl)methylidene]-4-thiazolone IUPAC Name: (5Z)-2-(4-benzhydrylpiperazin-4-ium-1-yl)-5-[(3-hydroxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-2-(4-benzhydrylpiperazin-4-ium-1-yl)-5-(3-hydroxybenzylidene)-2-thiazolin-4-one Formula: C27H26N3O2S+ MolecularWeight: 456.57924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=O)C(=CC5=CC(=CC=C5)O)S4

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=O)/C(=C/C5=CC(=CC=C5)O)/S4

InChI

InChI=1S/C27H25N3O2S/c31-23-13-7-8-20(18-23)19-24-26(32)28-27(33-24)30-16-14-29(15-17-30)25(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-13,18-19,25,31H,14-17H2/p+1/b24-19-