1-(4-methylphenyl)sulfonyl-1,4-diazepan-5-one

Systemtic Name: 1-(4-methylphenyl)sulfonyl-1,4-diazepan-5-one Openeye Name: 1-(p-tolylsulfonyl)-1,4-diazepan-5-one CAS Name: 1-(4-methylphenyl)sulfonyl-1,4-diazepan-5-one IUPAC Name: 1-(4-methylphenyl)sulfonyl-1,4-diazepan-5-one Traditional Name: 1-tosyl-1,4-diazepan-5-one Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)NCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)NCC2

InChI

InChI=1S/C12H16N2O3S/c1-10-2-4-11(5-3-10)18(16,17)14-8-6-12(15)13-7-9-14/h2-5H,6-9H2,1H3,(H,13,15)