N-(6-butyl-4-oxidanylidene-thiochromen-3-yl)-2,2,2-tris(chloranyl)ethanamide

Systemtic Name: N-(6-butyl-4-oxidanylidene-thiochromen-3-yl)-2,2,2-tris(chloranyl)ethanamide Openeye Name: N-(6-butyl-4-oxo-thiochromen-3-yl)-2,2,2-trichloro-acetamide CAS Name: N-(6-butyl-4-oxo-1-benzothiopyran-3-yl)-2,2,2-trichloroacetamide IUPAC Name: N-(6-butyl-4-oxothiochromen-3-yl)-2,2,2-trichloroacetamide Traditional Name: N-(6-butyl-4-keto-thiochromen-3-yl)-2,2,2-trichloro-acetamide Formula: C15H14Cl3NO2S MolecularWeight: 378.70116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)SC=C(C2=O)NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

CCCCC1=CC2=C(C=C1)SC=C(C2=O)NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C15H14Cl3NO2S/c1-2-3-4-9-5-6-12-10(7-9)13(20)11(8-22-12)19-14(21)15(16,17)18/h5-8H,2-4H2,1H3,(H,19,21)