N-[3-(azepan-1-ylsulfonyl)phenyl]-7-chloranyl-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-7-chloranyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-7-chloro-3-methyl-benzofuran-2-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-7-chloro-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-7-chloro-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-7-chloro-3-methyl-coumarilamide Formula: C22H23ClN2O4S MolecularWeight: 446.94702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2Cl)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2Cl)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H23ClN2O4S/c1-15-18-10-7-11-19(23)21(18)29-20(15)22(26)24-16-8-6-9-17(14-16)30(27,28)25-12-4-2-3-5-13-25/h6-11,14H,2-5,12-13H2,1H3,(H,24,26)