2-ethoxy-6-nitro-4-[[(5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2-ethoxy-6-nitro-4-[[(5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2-ethoxy-6-nitro-4-[[(5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 2-ethoxy-6-nitro-4-[[(5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2-ethoxy-6-nitro-4-[[(5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2-ethoxy-6-nitro-4-[[(5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C11H11N5O4S MolecularWeight: 309.30114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNN2C=NNC2=S)C=C(C1=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CNN2C=NNC2=S)C=C(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C11H11N5O4S/c1-2-20-9-4-7(3-8(10(9)17)16(18)19)5-13-15-6-12-14-11(15)21/h3-6,13H,2H2,1H3,(H,14,21)