5-(azepan-1-ylsulfonyl)-N-[2-(diethylcarbamoyl)phenyl]-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-(diethylcarbamoyl)phenyl]-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(diethylcarbamoyl)phenyl]-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-[diethylamino(oxo)methyl]phenyl]-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-(diethylcarbamoyl)phenyl]-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-(diethylcarbamoyl)phenyl]-2-methoxy-benzamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C25H33N3O5S/c1-4-27(5-2)25(30)20-12-8-9-13-22(20)26-24(29)21-18-19(14-15-23(21)33-3)34(31,32)28-16-10-6-7-11-17-28/h8-9,12-15,18H,4-7,10-11,16-17H2,1-3H3,(H,26,29)