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

Systemtic Name: 2-(azepan-1-yl)-5-[(4-bromophenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(azepan-1-yl)-5-[(4-bromophenyl)methylene]thiazol-4-one CAS Name: 2-(1-azepanyl)-5-[(4-bromophenyl)methylidene]-4-thiazolone IUPAC Name: 2-(azepan-1-yl)-5-[(4-bromophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(azepan-1-yl)-5-(4-bromobenzylidene)-2-thiazolin-4-one Formula: C16H17BrN2OS MolecularWeight: 365.28798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=O)C(=CC3=CC=C(C=C3)Br)S2

Isomeric SMILES

C1CCCN(CC1)C2=NC(=O)C(=CC3=CC=C(C=C3)Br)S2

InChI

InChI=1S/C16H17BrN2OS/c17-13-7-5-12(6-8-13)11-14-15(20)18-16(21-14)19-9-3-1-2-4-10-19/h5-8,11H,1-4,9-10H2