N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2-(1,2,4-triazol-1-yl)propanamide CAS Name: N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-[3-(2-ketopyrrolidino)benzyl]-2-(1,2,4-triazol-1-yl)propionamide Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)N2CCCC2=O)N3C=NC=N3

Isomeric SMILES

CC(C(=O)NCC1=CC(=CC=C1)N2CCCC2=O)N3C=NC=N3

InChI

InChI=1S/C16H19N5O2/c1-12(21-11-17-10-19-21)16(23)18-9-13-4-2-5-14(8-13)20-7-3-6-15(20)22/h2,4-5,8,10-12H,3,6-7,9H2,1H3,(H,18,23)