3-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]-1H-pyridin-2-one

Systemtic Name: 3-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]-1H-pyridin-2-one Openeye Name: 3-[4-(p-tolylsulfonyl)-1,4-diazepane-1-carbonyl]-1H-pyridin-2-one CAS Name: 3-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]-1H-pyridin-2-one IUPAC Name: 3-[4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbonyl]-1H-pyridin-2-one Traditional Name: 3-(4-tosyl-1,4-diazepane-1-carbonyl)-2-pyridone Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=CNC3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=CNC3=O

InChI

InChI=1S/C18H21N3O4S/c1-14-5-7-15(8-6-14)26(24,25)21-11-3-10-20(12-13-21)18(23)16-4-2-9-19-17(16)22/h2,4-9H,3,10-13H2,1H3,(H,19,22)