2-[2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4OC

Isomeric SMILES

CCN1C(=NN=C1SCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4OC

InChI

InChI=1S/C21H20N4O3S/c1-3-24-18(16-10-6-7-11-17(16)28-2)22-23-21(24)29-13-12-25-19(26)14-8-4-5-9-15(14)20(25)27/h4-11H,3,12-13H2,1-2H3