N-[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-ethylsulfanyl-benzamide

Systemtic Name: N-[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-ethylsulfanyl-benzamide Openeye Name: N-[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-ethylsulfanyl-benzamide CAS Name: N-[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-(ethylthio)benzamide IUPAC Name: N-[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-ethylsulfanylbenzamide Traditional Name: N-[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-(ethylthio)benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)SCC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)SCC)OCC

InChI

InChI=1S/C21H23N3O4S/c1-4-26-17-12-9-15(13-18(17)27-5-2)20-23-24-21(28-20)22-19(25)14-7-10-16(11-8-14)29-6-3/h7-13H,4-6H2,1-3H3,(H,22,24,25)