6-[[[3-(1,3-benzothiazol-2-yl)phenyl]amino]methylidene]-2-bromanyl-3,4-dimethyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[3-(1,3-benzothiazol-2-yl)phenyl]amino]methylidene]-2-bromanyl-3,4-dimethyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[3-(1,3-benzothiazol-2-yl)anilino]methylene]-2-bromo-3,4-dimethyl-cyclohexa-2,4-dien-1-one CAS Name: 6-[[3-(1,3-benzothiazol-2-yl)anilino]methylidene]-2-bromo-3,4-dimethyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[3-(1,3-benzothiazol-2-yl)anilino]methylidene]-2-bromo-3,4-dimethylcyclohexa-2,4-dien-1-one Traditional Name: 6-[[3-(1,3-benzothiazol-2-yl)anilino]methylene]-2-bromo-3,4-dimethyl-cyclohexa-2,4-dien-1-one Formula: C22H17BrN2OS MolecularWeight: 437.35218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C(=O)C(=C1C)Br

Isomeric SMILES

CC1=CC(=CNC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C(=O)C(=C1C)Br

InChI

InChI=1S/C22H17BrN2OS/c1-13-10-16(21(26)20(23)14(13)2)12-24-17-7-5-6-15(11-17)22-25-18-8-3-4-9-19(18)27-22/h3-12,24H,1-2H3