N-[[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[[3-methoxy-4-(tetrahydrofuran-2-ylmethoxy)phenyl]methyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[[3-methoxy-4-(2-oxolanylmethoxy)phenyl]methyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-[3-methoxy-4-(tetrahydrofurfuryloxy)benzyl]-4-(2-thienyl)butyramide Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)CCC(=O)C2=CC=CS2)OCC3CCCO3

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)CCC(=O)C2=CC=CS2)OCC3CCCO3

InChI

InChI=1S/C21H25NO5S/c1-25-19-12-15(6-8-18(19)27-14-16-4-2-10-26-16)13-22-21(24)9-7-17(23)20-5-3-11-28-20/h3,5-6,8,11-12,16H,2,4,7,9-10,13-14H2,1H3,(H,22,24)