6-[[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]amino]methylidene]-4-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]amino]methylidene]-4-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]amino]methylene]-4-bromo-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]amino]methylidene]-4-bromo-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]amino]methylidene]-4-bromo-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[[3-(3H-1,3-benzothiazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]amino]methylene]-4-bromo-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C21H15BrN2O3S MolecularWeight: 455.3244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNC2=CC(=C3NC4=CC=CC=C4S3)C(=O)C=C2)C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=CNC2=CC(=C3NC4=CC=CC=C4S3)C(=O)C=C2)C1=O)Br

InChI

InChI=1S/C21H15BrN2O3S/c1-27-18-9-13(22)8-12(20(18)26)11-23-14-6-7-17(25)15(10-14)21-24-16-4-2-3-5-19(16)28-21/h2-11,23-24H,1H3