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

Systemtic Name: 2-azanyl-5-[(4-nitro-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[(4-nitro-1,3-benzodioxol-5-yl)methylene]thiazol-4-one CAS Name: 2-amino-5-[(4-nitro-1,3-benzodioxol-5-yl)methylidene]-4-thiazolone IUPAC Name: 2-amino-5-[(4-nitro-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-amino-5-[(4-nitro-1,3-benzodioxol-5-yl)methylene]-2-thiazolin-4-one Formula: C11H7N3O5S MolecularWeight: 293.25538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7N3O5S/c12-11-13-10(15)7(20-11)3-5-1-2-6-9(19-4-18-6)8(5)14(16)17/h1-3H,4H2,(H2,12,13,15)