5-(azepan-1-ylsulfonyl)-2-methoxy-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(3-pyridylmethyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(3-pyridylmethyl)benzamide Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C20H25N3O4S/c1-27-19-9-8-17(28(25,26)23-11-4-2-3-5-12-23)13-18(19)20(24)22-15-16-7-6-10-21-14-16/h6-10,13-14H,2-5,11-12,15H2,1H3,(H,22,24)