N-[(3,4-dimethoxyphenyl)methyl]-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[(2R)-2-oxolanyl]methylthio]benzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide Traditional Name: 2-[[(2R)-tetrahydrofuran-2-yl]methylthio]-N-veratryl-benzamide Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC=CC=C2SCC3CCCO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC=CC=C2SC[C@H]3CCCO3)OC

InChI

InChI=1S/C21H25NO4S/c1-24-18-10-9-15(12-19(18)25-2)13-22-21(23)17-7-3-4-8-20(17)27-14-16-6-5-11-26-16/h3-4,7-10,12,16H,5-6,11,13-14H2,1-2H3,(H,22,23)/t16-/m1/s1