4-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[(2,1,3-benzothiadiazol-4-ylamino)methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 3-hydroxy-4-[(piazthiol-4-ylamino)methylene]cyclohexa-2,5-dien-1-one Formula: C13H9N3O2S MolecularWeight: 271.29446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)NC=C3C=CC(=O)C=C3O

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)NC=C3C=CC(=O)C=C3O

InChI

InChI=1S/C13H9N3O2S/c17-9-5-4-8(12(18)6-9)7-14-10-2-1-3-11-13(10)16-19-15-11/h1-7,14,18H