3-(azepan-1-ylsulfonyl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(3-methoxy-4-propoxyphenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(3-methoxy-4-propoxyphenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(3-methoxy-4-propoxy-benzyl)benzamide Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C24H32N2O5S/c1-3-15-31-22-12-11-19(16-23(22)30-2)18-25-24(27)20-9-8-10-21(17-20)32(28,29)26-13-6-4-5-7-14-26/h8-12,16-17H,3-7,13-15,18H2,1-2H3,(H,25,27)