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

Systemtic Name: 2-[2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4OC

Isomeric SMILES

CN1C(=NN=C1SCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4OC

InChI

InChI=1S/C20H18N4O3S/c1-23-17(15-9-5-6-10-16(15)27-2)21-22-20(23)28-12-11-24-18(25)13-7-3-4-8-14(13)19(24)26/h3-10H,11-12H2,1-2H3