N-[3-azanyl-5-(phenylmethyl)-1,2,4-triazol-4-yl]-3-oxidanylidene-butanamide

Systemtic Name: N-[3-azanyl-5-(phenylmethyl)-1,2,4-triazol-4-yl]-3-oxidanylidene-butanamide Openeye Name: N-(3-amino-5-benzyl-1,2,4-triazol-4-yl)-3-oxo-butanamide CAS Name: N-[3-amino-5-(phenylmethyl)-1,2,4-triazol-4-yl]-3-oxobutanamide IUPAC Name: N-(3-amino-5-benzyl-1,2,4-triazol-4-yl)-3-oxobutanamide Traditional Name: N-(3-amino-5-benzyl-1,2,4-triazol-4-yl)-3-keto-butyramide Formula: C13H15N5O2 MolecularWeight: 273.2905

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NN1C(=NN=C1N)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC(=O)NN1C(=NN=C1N)CC2=CC=CC=C2

InChI

InChI=1S/C13H15N5O2/c1-9(19)7-12(20)17-18-11(15-16-13(18)14)8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H2,14,16)(H,17,20)