4-ethoxy-N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-ethoxy-N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-ethoxy-N-[3-oxo-3-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]propyl]benzenesulfonamide CAS Name: 4-ethoxy-N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-ethoxy-N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-ethoxy-N-[3-keto-3-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]propyl]benzenesulfonamide Formula: C24H33N3O4S MolecularWeight: 459.60152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C24H33N3O4S/c1-3-31-22-9-11-23(12-10-22)32(29,30)25-14-13-24(28)27-16-4-15-26(17-18-27)19-21-7-5-20(2)6-8-21/h5-12,25H,3-4,13-19H2,1-2H3