6-[(4-ethyl-1,3-thiazol-2-yl)sulfanyl]-5-nitro-3H-2-benzofuran-1-one

Systemtic Name: 6-[(4-ethyl-1,3-thiazol-2-yl)sulfanyl]-5-nitro-3H-2-benzofuran-1-one Openeye Name: 6-(4-ethylthiazol-2-yl)sulfanyl-5-nitro-3H-isobenzofuran-1-one CAS Name: 6-[(4-ethyl-2-thiazolyl)thio]-5-nitro-3H-isobenzofuran-1-one IUPAC Name: 6-[(4-ethyl-1,3-thiazol-2-yl)sulfanyl]-5-nitro-3H-2-benzofuran-1-one Traditional Name: 6-[(4-ethylthiazol-2-yl)thio]-5-nitro-phthalide Formula: C13H10N2O4S2 MolecularWeight: 322.3595

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=N1)SC2=C(C=C3COC(=O)C3=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1=CSC(=N1)SC2=C(C=C3COC(=O)C3=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O4S2/c1-2-8-6-20-13(14-8)21-11-4-9-7(5-19-12(9)16)3-10(11)15(17)18/h3-4,6H,2,5H2,1H3