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

Systemtic Name: 1-[4-[ethyl-[1-(4-methylsulfonylphenyl)propan-2-yl]amino]butyl]-3-methyl-1,3-diazepan-2-one Openeye Name: 1-[4-[ethyl-[1-methyl-2-(4-methylsulfonylphenyl)ethyl]amino]butyl]-3-methyl-1,3-diazepan-2-one CAS Name: 1-[4-[ethyl-[1-(4-methylsulfonylphenyl)propan-2-yl]amino]butyl]-3-methyl-1,3-diazepan-2-one IUPAC Name: 1-[4-[ethyl-[1-(4-methylsulfonylphenyl)propan-2-yl]amino]butyl]-3-methyl-1,3-diazepan-2-one Traditional Name: 1-[4-[ethyl-[2-(4-mesylphenyl)-1-methyl-ethyl]amino]butyl]-3-methyl-1,3-diazepan-2-one Formula: C22H37N3O3S MolecularWeight: 423.61248

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCN1CCCCN(C1=O)C)C(C)CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCN(CCCCN1CCCCN(C1=O)C)C(C)CC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C22H37N3O3S/c1-5-24(15-8-9-17-25-16-7-6-14-23(3)22(25)26)19(2)18-20-10-12-21(13-11-20)29(4,27)28/h10-13,19H,5-9,14-18H2,1-4H3