1-ethanoyl-4-[4-[ethyl-[3-(4-methylsulfonylphenyl)butan-2-yl]amino]butyl]-1,4-diazepan-5-one

Systemtic Name: 1-ethanoyl-4-[4-[ethyl-[3-(4-methylsulfonylphenyl)butan-2-yl]amino]butyl]-1,4-diazepan-5-one Openeye Name: 1-acetyl-4-[4-[ethyl-[1-methyl-2-(4-methylsulfonylphenyl)propyl]amino]butyl]-1,4-diazepan-5-one CAS Name: 1-acetyl-4-[4-[ethyl-[3-(4-methylsulfonylphenyl)butan-2-yl]amino]butyl]-1,4-diazepan-5-one IUPAC Name: 1-acetyl-4-[4-[ethyl-[3-(4-methylsulfonylphenyl)butan-2-yl]amino]butyl]-1,4-diazepan-5-one Traditional Name: 1-acetyl-4-[4-[ethyl-[2-(4-mesylphenyl)-1-methyl-propyl]amino]butyl]-1,4-diazepan-5-one Formula: C24H39N3O4S MolecularWeight: 465.64916

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCN1CCN(CCC1=O)C(=O)C)C(C)C(C)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCN(CCCCN1CCN(CCC1=O)C(=O)C)C(C)C(C)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C24H39N3O4S/c1-6-25(20(3)19(2)22-9-11-23(12-10-22)32(5,30)31)14-7-8-15-27-18-17-26(21(4)28)16-13-24(27)29/h9-12,19-20H,6-8,13-18H2,1-5H3