3-[2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoyl]chromen-2-one

Systemtic Name: 3-[2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoyl]chromen-2-one Openeye Name: 3-[2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]chromen-2-one CAS Name: 3-[2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]chromen-2-one Traditional Name: 3-[2-[(5-p-phenetyl-1,3,4-oxadiazol-2-yl)thio]acetyl]coumarin Formula: C21H16N2O5S MolecularWeight: 408.42714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H16N2O5S/c1-2-26-15-9-7-13(8-10-15)19-22-23-21(28-19)29-12-17(24)16-11-14-5-3-4-6-18(14)27-20(16)25/h3-11H,2,12H2,1H3