4-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-methoxy-chromen-2-one CAS Name: 4-[[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-methoxychromen-2-one Traditional Name: 7-methoxy-4-[[(5-p-phenetyl-1,3,4-oxadiazol-2-yl)thio]methyl]coumarin Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC(=O)OC4=C3C=CC(=C4)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC(=O)OC4=C3C=CC(=C4)OC

InChI

InChI=1S/C21H18N2O5S/c1-3-26-15-6-4-13(5-7-15)20-22-23-21(28-20)29-12-14-10-19(24)27-18-11-16(25-2)8-9-17(14)18/h4-11H,3,12H2,1-2H3