5-[(2-bromophenyl)methylidene]-2-[4-(diphenylmethyl)piperidin-1-yl]-1,3-thiazol-4-one

Systemtic Name: 5-[(2-bromophenyl)methylidene]-2-[4-(diphenylmethyl)piperidin-1-yl]-1,3-thiazol-4-one Openeye Name: 2-(4-benzhydryl-1-piperidyl)-5-[(2-bromophenyl)methylene]thiazol-4-one CAS Name: 5-[(2-bromophenyl)methylidene]-2-[4-(diphenylmethyl)-1-piperidinyl]-4-thiazolone IUPAC Name: 2-(4-benzhydrylpiperidin-1-yl)-5-[(2-bromophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(4-benzhydrylpiperidino)-5-(2-bromobenzylidene)-2-thiazolin-4-one Formula: C28H25BrN2OS MolecularWeight: 517.4799

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=O)C(=CC5=CC=CC=C5Br)S4

Isomeric SMILES

C1CN(CCC1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=O)C(=CC5=CC=CC=C5Br)S4

InChI

InChI=1S/C28H25BrN2OS/c29-24-14-8-7-13-23(24)19-25-27(32)30-28(33-25)31-17-15-22(16-18-31)26(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,19,22,26H,15-18H2