4-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]pentanamide

Systemtic Name: 4-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]pentanamide Openeye Name: 4-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]pentanamide CAS Name: 4-methyl-N-[4-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]phenyl]pentanamide IUPAC Name: 4-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]pentanamide Traditional Name: 4-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]valeramide Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=CC=C(C=C1)NC(=O)C(C)N2C=NC=N2

Isomeric SMILES

CC(C)CCC(=O)NC1=CC=C(C=C1)NC(=O)C(C)N2C=NC=N2

InChI

InChI=1S/C17H23N5O2/c1-12(2)4-9-16(23)20-14-5-7-15(8-6-14)21-17(24)13(3)22-11-18-10-19-22/h5-8,10-13H,4,9H2,1-3H3,(H,20,23)(H,21,24)