1-(2-hydroxyphenyl)carbonyl-4-[4-[1-(4-methylsulfonylphenyl)propan-2-yl-propyl-amino]butyl]-1,4-diazepan-5-one

Systemtic Name: 1-(2-hydroxyphenyl)carbonyl-4-[4-[1-(4-methylsulfonylphenyl)propan-2-yl-propyl-amino]butyl]-1,4-diazepan-5-one Openeye Name: 1-(2-hydroxybenzoyl)-4-[4-[[1-methyl-2-(4-methylsulfonylphenyl)ethyl]-propyl-amino]butyl]-1,4-diazepan-5-one CAS Name: 1-[(2-hydroxyphenyl)-oxomethyl]-4-[4-[1-(4-methylsulfonylphenyl)propan-2-yl-propylamino]butyl]-1,4-diazepan-5-one IUPAC Name: 1-(2-hydroxybenzoyl)-4-[4-[1-(4-methylsulfonylphenyl)propan-2-yl-propylamino]butyl]-1,4-diazepan-5-one Traditional Name: 4-[4-[[2-(4-mesylphenyl)-1-methyl-ethyl]-propyl-amino]butyl]-1-salicyloyl-1,4-diazepan-5-one Formula: C29H41N3O5S MolecularWeight: 543.71794

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCN1CCN(CCC1=O)C(=O)C2=CC=CC=C2O)C(C)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCN(CCCCN1CCN(CCC1=O)C(=O)C2=CC=CC=C2O)C(C)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C29H41N3O5S/c1-4-16-30(23(2)22-24-11-13-25(14-12-24)38(3,36)37)17-7-8-18-31-20-21-32(19-15-28(31)34)29(35)26-9-5-6-10-27(26)33/h5-6,9-14,23,33H,4,7-8,15-22H2,1-3H3