5-(azepan-1-ylsulfonyl)-2-methoxy-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-[[2-(2-methyl-1-imidazolyl)phenyl]methyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[2-(2-methylimidazol-1-yl)benzyl]benzamide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=CC=C2CNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC

Isomeric SMILES

CC1=NC=CN1C2=CC=CC=C2CNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC

InChI

InChI=1S/C25H30N4O4S/c1-19-26-13-16-29(19)23-10-6-5-9-20(23)18-27-25(30)22-17-21(11-12-24(22)33-2)34(31,32)28-14-7-3-4-8-15-28/h5-6,9-13,16-17H,3-4,7-8,14-15,18H2,1-2H3,(H,27,30)