2-propan-2-yl-5-[5-(1,2,4-triazol-4-yliminomethyl)furan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-propan-2-yl-5-[5-(1,2,4-triazol-4-yliminomethyl)furan-2-yl]isoindole-1,3-dione Openeye Name: 2-isopropyl-5-[5-(1,2,4-triazol-4-yliminomethyl)-2-furyl]isoindoline-1,3-dione CAS Name: 2-propan-2-yl-5-[5-(1,2,4-triazol-4-yliminomethyl)-2-furanyl]isoindole-1,3-dione IUPAC Name: 2-propan-2-yl-5-[5-(1,2,4-triazol-4-yliminomethyl)furan-2-yl]isoindole-1,3-dione Traditional Name: 2-isopropyl-5-[5-(1,2,4-triazol-4-yliminomethyl)-2-furyl]isoindoline-1,3-quinone Formula: C18H15N5O3 MolecularWeight: 349.3434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C3=CC=C(O3)C=NN4C=NN=C4

Isomeric SMILES

CC(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C3=CC=C(O3)C=NN4C=NN=C4

InChI

InChI=1S/C18H15N5O3/c1-11(2)23-17(24)14-5-3-12(7-15(14)18(23)25)16-6-4-13(26-16)8-21-22-9-19-20-10-22/h3-11H,1-2H3