N-(1,3-benzothiazol-2-yl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-[(cyclohexylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-[(cyclohexylthio)methyl]coumarilamide Formula: C23H22N2O2S2 MolecularWeight: 422.56298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H22N2O2S2/c26-22(25-23-24-18-11-5-7-13-20(18)29-23)21-17(14-28-15-8-2-1-3-9-15)16-10-4-6-12-19(16)27-21/h4-7,10-13,15H,1-3,8-9,14H2,(H,24,25,26)