6-[[2-(1,3-benzothiazol-2-yl)hydrazinyl]methylidene]-2-bromanyl-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-(1,3-benzothiazol-2-yl)hydrazinyl]methylidene]-2-bromanyl-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-(1,3-benzothiazol-2-yl)hydrazino]methylene]-2-bromo-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[(1,3-benzothiazol-2-ylhydrazo)methylidene]-2-bromo-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(1,3-benzothiazol-2-yl)hydrazinyl]methylidene]-2-bromo-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[N'-(1,3-benzothiazol-2-yl)hydrazino]methylene]-2-bromo-4-nitro-cyclohexa-2,4-dien-1-one Formula: C14H9BrN4O3S MolecularWeight: 393.21526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NNC=C3C=C(C=C(C3=O)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NNC=C3C=C(C=C(C3=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H9BrN4O3S/c15-10-6-9(19(21)22)5-8(13(10)20)7-16-18-14-17-11-3-1-2-4-12(11)23-14/h1-7,16H,(H,17,18)