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

Systemtic Name: 4-(chloromethylsulfonyl)-1-[4-[[2-methyl-1-(4-methylsulfonylphenyl)pentan-3-yl]amino]butyl]-1,4-diazepan-2-one Openeye Name: 4-(chloromethylsulfonyl)-1-[4-[[1-ethyl-2-methyl-3-(4-methylsulfonylphenyl)propyl]amino]butyl]-1,4-diazepan-2-one CAS Name: 4-(chloromethylsulfonyl)-1-[4-[[2-methyl-1-(4-methylsulfonylphenyl)pentan-3-yl]amino]butyl]-1,4-diazepan-2-one IUPAC Name: 4-(chloromethylsulfonyl)-1-[4-[[2-methyl-1-(4-methylsulfonylphenyl)pentan-3-yl]amino]butyl]-1,4-diazepan-2-one Traditional Name: 4-(chloromethylsulfonyl)-1-[4-[[1-ethyl-3-(4-mesylphenyl)-2-methyl-propyl]amino]butyl]-1,4-diazepan-2-one Formula: C23H38ClN3O5S2 MolecularWeight: 536.14792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)CC1=CC=C(C=C1)S(=O)(=O)C)NCCCCN2CCCN(CC2=O)S(=O)(=O)CCl

Isomeric SMILES

CCC(C(C)CC1=CC=C(C=C1)S(=O)(=O)C)NCCCCN2CCCN(CC2=O)S(=O)(=O)CCl

InChI

InChI=1S/C23H38ClN3O5S2/c1-4-22(19(2)16-20-8-10-21(11-9-20)33(3,29)30)25-12-5-6-13-26-14-7-15-27(17-23(26)28)34(31,32)18-24/h8-11,19,22,25H,4-7,12-18H2,1-3H3