(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-phenylazanyl-1,3-thiazol-4-one

Systemtic Name: (5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-phenylazanyl-1,3-thiazol-4-one Openeye Name: (5E)-2-anilino-5-[(6-nitro-1,3-benzodioxol-5-yl)methylene]thiazol-4-one CAS Name: (5E)-2-anilino-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-anilino-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-anilino-5-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-2-thiazolin-4-one Formula: C17H11N3O5S MolecularWeight: 369.35134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=C3C(=O)N=C(S3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C/3\C(=O)N=C(S3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O5S/c21-16-15(26-17(19-16)18-11-4-2-1-3-5-11)7-10-6-13-14(25-9-24-13)8-12(10)20(22)23/h1-8H,9H2,(H,18,19,21)/b15-7+