4-[4-[[1-(4-ethylsulfonylphenyl)-2-methyl-pentan-3-yl]amino]butyl]-1,4-diazepan-5-one

Systemtic Name: 4-[4-[[1-(4-ethylsulfonylphenyl)-2-methyl-pentan-3-yl]amino]butyl]-1,4-diazepan-5-one Openeye Name: 4-[4-[[1-ethyl-3-(4-ethylsulfonylphenyl)-2-methyl-propyl]amino]butyl]-1,4-diazepan-5-one CAS Name: 4-[4-[[1-(4-ethylsulfonylphenyl)-2-methylpentan-3-yl]amino]butyl]-1,4-diazepan-5-one IUPAC Name: 4-[4-[[1-(4-ethylsulfonylphenyl)-2-methylpentan-3-yl]amino]butyl]-1,4-diazepan-5-one Traditional Name: 4-[4-[[3-(4-esylphenyl)-1-ethyl-2-methyl-propyl]amino]butyl]-1,4-diazepan-5-one Formula: C23H39N3O3S MolecularWeight: 437.63906

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)CC1=CC=C(C=C1)S(=O)(=O)CC)NCCCCN2CCNCCC2=O

Isomeric SMILES

CCC(C(C)CC1=CC=C(C=C1)S(=O)(=O)CC)NCCCCN2CCNCCC2=O

InChI

InChI=1S/C23H39N3O3S/c1-4-22(25-13-6-7-16-26-17-15-24-14-12-23(26)27)19(3)18-20-8-10-21(11-9-20)30(28,29)5-2/h8-11,19,22,24-25H,4-7,12-18H2,1-3H3