3-[(3-azido-1-benzothiophen-2-yl)methylidene]pentane-2,4-dione

Systemtic Name: 3-[(3-azido-1-benzothiophen-2-yl)methylidene]pentane-2,4-dione Openeye Name: 3-[(3-azidobenzothiophen-2-yl)methylene]pentane-2,4-dione CAS Name: 3-[(3-azido-1-benzothiophen-2-yl)methylidene]pentane-2,4-dione IUPAC Name: 3-[(3-azido-1-benzothiophen-2-yl)methylidene]pentane-2,4-dione Traditional Name: 3-[(3-azidobenzothiophen-2-yl)methylene]pentane-2,4-dione Formula: C14H11N3O2S MolecularWeight: 285.32104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=C(C2=CC=CC=C2S1)N=[N+]=[N-])C(=O)C

Isomeric SMILES

CC(=O)C(=CC1=C(C2=CC=CC=C2S1)N=[N+]=[N-])C(=O)C

InChI

InChI=1S/C14H11N3O2S/c1-8(18)11(9(2)19)7-13-14(16-17-15)10-5-3-4-6-12(10)20-13/h3-7H,1-2H3