3,4-diethoxy-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide

Systemtic Name: 3,4-diethoxy-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Openeye Name: 3,4-diethoxy-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide CAS Name: 3,4-diethoxy-N-[5-[[4-(methylthio)phenyl]methyl]-1,3,4-oxadiazol-2-yl]benzamide IUPAC Name: 3,4-diethoxy-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Traditional Name: 3,4-diethoxy-N-[5-[4-(methylthio)benzyl]-1,3,4-oxadiazol-2-yl]benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)SC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)SC)OCC

InChI

InChI=1S/C21H23N3O4S/c1-4-26-17-11-8-15(13-18(17)27-5-2)20(25)22-21-24-23-19(28-21)12-14-6-9-16(29-3)10-7-14/h6-11,13H,4-5,12H2,1-3H3,(H,22,24,25)