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

Systemtic Name: 6-chloranyl-4-[[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-ethyl-chromen-2-one Openeye Name: 6-chloro-4-[[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-ethyl-chromen-2-one CAS Name: 6-chloro-4-[[[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-ethylchromen-2-one Traditional Name: 6-chloro-7-ethyl-4-[[(5-o-phenetyl-1,3,4-oxadiazol-2-yl)thio]methyl]coumarin Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(O3)C4=CC=CC=C4OCC)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(O3)C4=CC=CC=C4OCC)Cl

InChI

InChI=1S/C22H19ClN2O4S/c1-3-13-9-19-16(11-17(13)23)14(10-20(26)28-19)12-30-22-25-24-21(29-22)15-7-5-6-8-18(15)27-4-2/h5-11H,3-4,12H2,1-2H3