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

Systemtic Name: 4-methyl-1-[4-[1-(4-methylsulfonylphenyl)propan-2-yl-propyl-amino]butyl]-1,4-diazepan-2-one Openeye Name: 4-methyl-1-[4-[[1-methyl-2-(4-methylsulfonylphenyl)ethyl]-propyl-amino]butyl]-1,4-diazepan-2-one CAS Name: 4-methyl-1-[4-[1-(4-methylsulfonylphenyl)propan-2-yl-propylamino]butyl]-1,4-diazepan-2-one IUPAC Name: 4-methyl-1-[4-[1-(4-methylsulfonylphenyl)propan-2-yl-propylamino]butyl]-1,4-diazepan-2-one Traditional Name: 1-[4-[[2-(4-mesylphenyl)-1-methyl-ethyl]-propyl-amino]butyl]-4-methyl-1,4-diazepan-2-one Formula: C23H39N3O3S MolecularWeight: 437.63906

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCN1CCCN(CC1=O)C)C(C)CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCN(CCCCN1CCCN(CC1=O)C)C(C)CC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C23H39N3O3S/c1-5-13-25(15-6-7-16-26-17-8-14-24(3)19-23(26)27)20(2)18-21-9-11-22(12-10-21)30(4,28)29/h9-12,20H,5-8,13-19H2,1-4H3