2-cyano-N-(phenylmethyl)-3-(pyridin-3-ylmethylamino)but-2-enamide

Systemtic Name: 2-cyano-N-(phenylmethyl)-3-(pyridin-3-ylmethylamino)but-2-enamide Openeye Name: N-benzyl-2-cyano-3-(3-pyridylmethylamino)but-2-enamide CAS Name: 2-cyano-N-(phenylmethyl)-3-(3-pyridinylmethylamino)-2-butenamide IUPAC Name: N-benzyl-2-cyano-3-(pyridin-3-ylmethylamino)but-2-enamide Traditional Name: N-benzyl-2-cyano-3-(3-pyridylmethylamino)but-2-enamide Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)NCC1=CC=CC=C1)NCC2=CN=CC=C2

Isomeric SMILES

CC(=C(C#N)C(=O)NCC1=CC=CC=C1)NCC2=CN=CC=C2

InChI

InChI=1S/C18H18N4O/c1-14(21-13-16-8-5-9-20-11-16)17(10-19)18(23)22-12-15-6-3-2-4-7-15/h2-9,11,21H,12-13H2,1H3,(H,22,23)