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

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

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

InChI

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