N-ethyl-N-[5-(4-methyl-1,4-diazepan-1-yl)-2-(phenylsulfonyl)phenyl]ethanamide

Systemtic Name: N-ethyl-N-[5-(4-methyl-1,4-diazepan-1-yl)-2-(phenylsulfonyl)phenyl]ethanamide Openeye Name: N-[2-(benzenesulfonyl)-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-ethyl-acetamide CAS Name: N-[2-(benzenesulfonyl)-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-ethylacetamide IUPAC Name: N-[2-(benzenesulfonyl)-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-ethylacetamide Traditional Name: N-[2-besyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-ethyl-acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CCN(C1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C22H29N3O3S/c1-4-25(18(2)26)21-17-19(24-14-8-13-23(3)15-16-24)11-12-22(21)29(27,28)20-9-6-5-7-10-20/h5-7,9-12,17H,4,8,13-16H2,1-3H3