3-[[5-(1-benzofuran-2-yl)-1,2,4-triazin-3-yl]sulfanyl]-1-phenyl-pyrrolidine-2,5-dione

Systemtic Name: 3-[[5-(1-benzofuran-2-yl)-1,2,4-triazin-3-yl]sulfanyl]-1-phenyl-pyrrolidine-2,5-dione Openeye Name: 3-[[5-(benzofuran-2-yl)-1,2,4-triazin-3-yl]sulfanyl]-1-phenyl-pyrrolidine-2,5-dione CAS Name: 3-[[5-(2-benzofuranyl)-1,2,4-triazin-3-yl]thio]-1-phenylpyrrolidine-2,5-dione IUPAC Name: 3-[[5-(1-benzofuran-2-yl)-1,2,4-triazin-3-yl]sulfanyl]-1-phenylpyrrolidine-2,5-dione Traditional Name: 3-[[5-(benzofuran-2-yl)-1,2,4-triazin-3-yl]thio]-1-phenyl-pyrrolidine-2,5-quinone Formula: C21H14N4O3S MolecularWeight: 402.42586

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=CC=C2)SC3=NC(=CN=N3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=CC=C2)SC3=NC(=CN=N3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C21H14N4O3S/c26-19-11-18(20(27)25(19)14-7-2-1-3-8-14)29-21-23-15(12-22-24-21)17-10-13-6-4-5-9-16(13)28-17/h1-10,12,18H,11H2