2-[2-(4-ethanoyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-ethanoyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)ethyl]isoindoline-1,3-quinone Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC(=N1)CCN2C(=O)C3=CC=CC=C3C2=O)(C)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C(SC(=N1)CCN2C(=O)C3=CC=CC=C3C2=O)(C)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O3S/c1-14(25)24-21(2,15-8-4-3-5-9-15)28-18(22-24)12-13-23-19(26)16-10-6-7-11-17(16)20(23)27/h3-11H,12-13H2,1-2H3