3-(azepan-1-ylsulfonyl)-N-[2-(2-methoxyethylcarbamoyl)phenyl]-4-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[2-(2-methoxyethylcarbamoyl)phenyl]-4-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[2-(2-methoxyethylcarbamoyl)phenyl]-4-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-[(2-methoxyethylamino)-oxomethyl]phenyl]-4-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[2-(2-methoxyethylcarbamoyl)phenyl]-4-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-(2-methoxyethylcarbamoyl)phenyl]-4-methyl-benzamide Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCCOC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCCOC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H31N3O5S/c1-18-11-12-19(17-22(18)33(30,31)27-14-7-3-4-8-15-27)23(28)26-21-10-6-5-9-20(21)24(29)25-13-16-32-2/h5-6,9-12,17H,3-4,7-8,13-16H2,1-2H3,(H,25,29)(H,26,28)