N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]triazole-4-carboxamide CAS Name: N-[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]triazole-4-carboxamide Traditional Name: 1-benzyl-N-[4-(2-ketopyrrolidino)-3-methyl-phenyl]triazole-4-carboxamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3)N4CCCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3)N4CCCC4=O

InChI

InChI=1S/C21H21N5O2/c1-15-12-17(9-10-19(15)26-11-5-8-20(26)27)22-21(28)18-14-25(24-23-18)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,14H,5,8,11,13H2,1H3,(H,22,28)