4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-methoxyethyl)-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-methoxyethyl)-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-methoxyethyl)-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-methoxyethyl)-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-methoxyethyl)-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 1,1-diketo-2-(2-methoxyethyl)-5-phenyl-4-(piperonylamino)isothiazol-3-one Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O6S/c1-26-10-9-22-20(23)18(19(29(22,24)25)15-5-3-2-4-6-15)21-12-14-7-8-16-17(11-14)28-13-27-16/h2-8,11,21H,9-10,12-13H2,1H3