N-(2-chloranyl-6-methyl-phenyl)-3-methyl-5-morpholin-4-ylsulfonyl-1-benzofuran-2-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-3-methyl-5-morpholin-4-ylsulfonyl-1-benzofuran-2-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-3-methyl-5-morpholinosulfonyl-benzofuran-2-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-3-methyl-5-(4-morpholinylsulfonyl)-2-benzofurancarboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-3-methyl-5-morpholin-4-ylsulfonyl-1-benzofuran-2-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-3-methyl-5-morpholinosulfonyl-coumarilamide Formula: C21H21ClN2O5S MolecularWeight: 448.91984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C21H21ClN2O5S/c1-13-4-3-5-17(22)19(13)23-21(25)20-14(2)16-12-15(6-7-18(16)29-20)30(26,27)24-8-10-28-11-9-24/h3-7,12H,8-11H2,1-2H3,(H,23,25)