1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)isoindole-5-carboxamide Openeye Name: 2-benzyl-1,3-dioxo-N-(1H-1,2,4-triazol-5-yl)isoindoline-5-carboxamide CAS Name: 1,3-dioxo-2-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)-5-isoindolecarboxamide IUPAC Name: 2-benzyl-1,3-dioxo-N-(1H-1,2,4-triazol-5-yl)isoindole-5-carboxamide Traditional Name: 2-benzyl-1,3-diketo-N-(1H-1,2,4-triazol-5-yl)isoindoline-5-carboxamide Formula: C18H13N5O3 MolecularWeight: 347.32752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=NC=NN4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=NC=NN4

InChI

InChI=1S/C18H13N5O3/c24-15(21-18-19-10-20-22-18)12-6-7-13-14(8-12)17(26)23(16(13)25)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H2,19,20,21,22,24)