N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-1-keto-isochroman-3-carboxamide Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CC2=CC=CC=C2C(=O)O1)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1CC2=CC=CC=C2C(=O)O1)C3=CSC=C3

InChI

InChI=1S/C18H20N2O3S/c1-20(2)15(13-7-8-24-11-13)10-19-17(21)16-9-12-5-3-4-6-14(12)18(22)23-16/h3-8,11,15-16H,9-10H2,1-2H3,(H,19,21)