1,3-bis(oxidanylidene)-N-propan-2-yl-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-N-propan-2-yl-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]isoindole-5-carboxamide Openeye Name: N-isopropyl-1,3-dioxo-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]isoindoline-5-carboxamide CAS Name: 1,3-dioxo-N-propan-2-yl-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-5-isoindolecarboxamide IUPAC Name: 1,3-dioxo-N-propan-2-yl-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]isoindole-5-carboxamide Traditional Name: N-isopropyl-1,3-diketo-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]isoindoline-5-carboxamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C21H19N5O3/c1-13(2)24-19(27)15-5-8-17-18(9-15)21(29)26(20(17)28)16-6-3-14(4-7-16)10-25-12-22-11-23-25/h3-9,11-13H,10H2,1-2H3,(H,24,27)