5-(azepan-1-ylsulfonyl)-2-methoxy-N-(5-methylpyridin-2-yl)benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(5-methylpyridin-2-yl)benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(5-methyl-2-pyridyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-(5-methyl-2-pyridinyl)benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(5-methylpyridin-2-yl)benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(5-methyl-2-pyridyl)benzamide Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=CN=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C20H25N3O4S/c1-15-7-10-19(21-14-15)22-20(24)17-13-16(8-9-18(17)27-2)28(25,26)23-11-5-3-4-6-12-23/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,21,22,24)