N-ethyl-N-(4-methyl-1,4-diazepan-1-yl)-2-[3-(phenylsulfonyl)phenyl]ethanamide

Systemtic Name: N-ethyl-N-(4-methyl-1,4-diazepan-1-yl)-2-[3-(phenylsulfonyl)phenyl]ethanamide Openeye Name: 2-[3-(benzenesulfonyl)phenyl]-N-ethyl-N-(4-methyl-1,4-diazepan-1-yl)acetamide CAS Name: 2-[3-(benzenesulfonyl)phenyl]-N-ethyl-N-(4-methyl-1,4-diazepan-1-yl)acetamide IUPAC Name: 2-[3-(benzenesulfonyl)phenyl]-N-ethyl-N-(4-methyl-1,4-diazepan-1-yl)acetamide Traditional Name: 2-(3-besylphenyl)-N-ethyl-N-(4-methyl-1,4-diazepan-1-yl)acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)CC1=CC(=CC=C1)S(=O)(=O)C2=CC=CC=C2)N3CCCN(CC3)C

Isomeric SMILES

CCN(C(=O)CC1=CC(=CC=C1)S(=O)(=O)C2=CC=CC=C2)N3CCCN(CC3)C

InChI

InChI=1S/C22H29N3O3S/c1-3-25(24-14-8-13-23(2)15-16-24)22(26)18-19-9-7-12-21(17-19)29(27,28)20-10-5-4-6-11-20/h4-7,9-12,17H,3,8,13-16,18H2,1-2H3