2-[2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-methyl-3-(1-methylsulfonyl-4-piperidyl)-5-oxo-1,2,4-triazol-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-methyl-3-(1-methylsulfonyl-4-piperidinyl)-5-oxo-1,2,4-triazol-1-yl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxo-1,2,4-triazol-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[5-keto-3-(1-mesyl-4-piperidyl)-4-methyl-1,2,4-triazol-1-yl]ethyl]isoindoline-1,3-quinone Formula: C19H23N5O5S MolecularWeight: 433.48142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=O)CCN2C(=O)C3=CC=CC=C3C2=O)C4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CN1C(=NN(C1=O)CCN2C(=O)C3=CC=CC=C3C2=O)C4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C19H23N5O5S/c1-21-16(13-7-9-22(10-8-13)30(2,28)29)20-24(19(21)27)12-11-23-17(25)14-5-3-4-6-15(14)18(23)26/h3-6,13H,7-12H2,1-2H3