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

Systemtic Name: 4-[[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-6-ethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-6-ethyl-7-hydroxy-chromen-2-one CAS Name: 4-[[[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-6-ethyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-6-ethyl-7-hydroxychromen-2-one Traditional Name: 4-[[[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-6-ethyl-7-hydroxy-coumarin Formula: C20H15ClN2O4S MolecularWeight: 414.8621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=C(O3)C4=CC(=CC=C4)Cl)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=C(O3)C4=CC(=CC=C4)Cl)O

InChI

InChI=1S/C20H15ClN2O4S/c1-2-11-7-15-13(8-18(25)26-17(15)9-16(11)24)10-28-20-23-22-19(27-20)12-4-3-5-14(21)6-12/h3-9,24H,2,10H2,1H3