6-[5-(methylamino)-1,2,4-thiadiazol-3-ylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-(methylamino)-1,2,4-thiadiazol-3-ylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-(methylamino)-1,2,4-thiadiazol-3-ylidene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[5-(methylamino)-1,2,4-thiadiazol-3-ylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-(methylamino)-1,2,4-thiadiazol-3-ylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[5-(methylamino)-1,2,4-thiadiazol-3-ylidene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C9H8N4O3S MolecularWeight: 252.24982

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=C2C=C(C=CC2=O)[N+](=O)[O-])NS1

Isomeric SMILES

CNC1=NC(=C2C=C(C=CC2=O)[N+](=O)[O-])NS1

InChI

InChI=1S/C9H8N4O3S/c1-10-9-11-8(12-17-9)6-4-5(13(15)16)2-3-7(6)14/h2-4,12H,1H3,(H,10,11)