3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-methyl-5-(propanoylamino)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-methyl-5-(propanoylamino)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-methyl-5-(propanoylamino)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[2-methyl-5-(1-oxopropylamino)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-methyl-5-(propanoylamino)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-methyl-5-propionamido-phenyl)benzamide Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H31N3O5S/c1-4-23(28)25-19-11-9-17(2)20(16-19)26-24(29)18-10-12-21(32-3)22(15-18)33(30,31)27-13-7-5-6-8-14-27/h9-12,15-16H,4-8,13-14H2,1-3H3,(H,25,28)(H,26,29)