5-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyridin-2-one

Systemtic Name: 5-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyridin-2-one Openeye Name: 5-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine-1-carbonyl]-1H-pyridin-2-one CAS Name: 5-[oxo-[4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-1-piperazinyl]methyl]-1H-pyridin-2-one IUPAC Name: 5-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine-1-carbonyl]-1H-pyridin-2-one Traditional Name: 5-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine-1-carbonyl]-2-pyridone Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CNC(=O)C=C3)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CNC(=O)C=C3)C)C

InChI

InChI=1S/C21H27N3O4S/c1-13-14(2)16(4)20(17(5)15(13)3)29(27,28)24-10-8-23(9-11-24)21(26)18-6-7-19(25)22-12-18/h6-7,12H,8-11H2,1-5H3,(H,22,25)