[4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxylate Openeye Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxylate CAS Name: 3-[(cyclohexylthio)methyl]-2-benzofurancarboxylic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester IUPAC Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-[(cyclohexylthio)methyl]coumarilic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)OC4=CC=C(C=C4)C5=NN=CO5

Isomeric SMILES

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)OC4=CC=C(C=C4)C5=NN=CO5

InChI

InChI=1S/C24H22N2O4S/c27-24(29-17-12-10-16(11-13-17)23-26-25-15-28-23)22-20(14-31-18-6-2-1-3-7-18)19-8-4-5-9-21(19)30-22/h4-5,8-13,15,18H,1-3,6-7,14H2