6-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-4-bromanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-4-bromanyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(2,1,3-benzothiadiazol-4-ylamino)methylene]-4-bromo-cyclohexa-2,4-dien-1-one CAS Name: 6-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-4-bromo-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-4-bromocyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[(piazthiol-4-ylamino)methylene]cyclohexa-2,4-dien-1-one Formula: C13H8BrN3OS MolecularWeight: 334.19112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)NC=C3C=C(C=CC3=O)Br

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)NC=C3C=C(C=CC3=O)Br

InChI

InChI=1S/C13H8BrN3OS/c14-9-4-5-12(18)8(6-9)7-15-10-2-1-3-11-13(10)17-19-16-11/h1-7,15H