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

Systemtic Name: 4-[[(6-bromanyl-1,3-benzothiazol-2-yl)amino]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(6-bromo-1,3-benzothiazol-2-yl)amino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(6-bromo-1,3-benzothiazol-2-yl)amino]methylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(6-bromo-1,3-benzothiazol-2-yl)amino]methylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[(6-bromo-1,3-benzothiazol-2-yl)amino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C14H9BrN2O2S MolecularWeight: 349.20246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=N2)NC=C3C=CC(=O)C=C3O

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=N2)NC=C3C=CC(=O)C=C3O

InChI

InChI=1S/C14H9BrN2O2S/c15-9-2-4-11-13(5-9)20-14(17-11)16-7-8-1-3-10(18)6-12(8)19/h1-7,19H,(H,16,17)