5-cyclopropyl-2-[4-(4-fluoranylphenoxy)phenyl]-N-methyl-6-[3-methylsulfanylpropyl(methylsulfonyl)amino]-1-benzofuran-3-carboxamide

Systemtic Name: 5-cyclopropyl-2-[4-(4-fluoranylphenoxy)phenyl]-N-methyl-6-[3-methylsulfanylpropyl(methylsulfonyl)amino]-1-benzofuran-3-carboxamide Openeye Name: 5-cyclopropyl-2-[4-(4-fluorophenoxy)phenyl]-N-methyl-6-[3-methylsulfanylpropyl(methylsulfonyl)amino]benzofuran-3-carboxamide CAS Name: 5-cyclopropyl-2-[4-(4-fluorophenoxy)phenyl]-N-methyl-6-[methylsulfonyl-[3-(methylthio)propyl]amino]-3-benzofurancarboxamide IUPAC Name: 5-cyclopropyl-2-[4-(4-fluorophenoxy)phenyl]-N-methyl-6-[3-methylsulfanylpropyl(methylsulfonyl)amino]-1-benzofuran-3-carboxamide Traditional Name: 5-cyclopropyl-2-[4-(4-fluorophenoxy)phenyl]-6-[mesyl-[3-(methylthio)propyl]amino]-N-methyl-benzofuran-3-carboxamide Formula: C30H31FN2O5S2 MolecularWeight: 582.705943

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCCSC)S(=O)(=O)C)C4=CC=C(C=C4)OC5=CC=C(C=C5)F

Isomeric SMILES

CNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCCSC)S(=O)(=O)C)C4=CC=C(C=C4)OC5=CC=C(C=C5)F

InChI

InChI=1S/C30H31FN2O5S2/c1-32-30(34)28-25-17-24(19-5-6-19)26(33(40(3,35)36)15-4-16-39-2)18-27(25)38-29(28)20-7-11-22(12-8-20)37-23-13-9-21(31)10-14-23/h7-14,17-19H,4-6,15-16H2,1-3H3,(H,32,34)