N-(1,3-benzodioxol-5-ylmethyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(cyclohexylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-piperonyl-coumarilamide Formula: C24H25NO4S MolecularWeight: 423.5246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H25NO4S/c26-24(25-13-16-10-11-21-22(12-16)28-15-27-21)23-19(14-30-17-6-2-1-3-7-17)18-8-4-5-9-20(18)29-23/h4-5,8-12,17H,1-3,6-7,13-15H2,(H,25,26)