(2S)-2-ethoxy-6-nitro-3-[[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methylidene]chromen-4-one

Systemtic Name: (2S)-2-ethoxy-6-nitro-3-[[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methylidene]chromen-4-one Openeye Name: (2S)-2-ethoxy-6-nitro-3-[[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)amino]methylene]chroman-4-one CAS Name: (2S)-2-ethoxy-6-nitro-3-[[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methylidene]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (2S)-2-ethoxy-6-nitro-3-[[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methylidene]chromen-4-one Traditional Name: (2S)-2-ethoxy-6-nitro-3-[[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)amino]methylene]chroman-4-one Formula: C14H12N4O5S2 MolecularWeight: 380.39888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(=CNC2=NNC(=S)S2)C(=O)C3=C(O1)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCO[C@@H]1C(=CNC2=NNC(=S)S2)C(=O)C3=C(O1)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O5S2/c1-2-22-12-9(6-15-13-16-17-14(24)25-13)11(19)8-5-7(18(20)21)3-4-10(8)23-12/h3-6,12H,2H2,1H3,(H,15,16)(H,17,24)/t12-/m0/s1