3-ethyl-6-methyl-5-[5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]-1H-pyridin-2-one

Systemtic Name: 3-ethyl-6-methyl-5-[5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]-1H-pyridin-2-one Openeye Name: 3-ethyl-6-methyl-5-[5-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-2-thienyl]-1H-pyridin-2-one CAS Name: 3-ethyl-6-methyl-5-[5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]-1H-pyridin-2-one IUPAC Name: 3-ethyl-6-methyl-5-[5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]-1H-pyridin-2-one Traditional Name: 3-ethyl-6-methyl-5-[5-[4-(2-pyridyl)piperazino]sulfonyl-2-thienyl]-2-pyridone Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(NC1=O)C)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCC1=CC(=C(NC1=O)C)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C21H24N4O3S2/c1-3-16-14-17(15(2)23-21(16)26)18-7-8-20(29-18)30(27,28)25-12-10-24(11-13-25)19-6-4-5-9-22-19/h4-9,14H,3,10-13H2,1-2H3,(H,23,26)