ethyl (E)-3-azanyl-2-cyano-5-oxidanylidene-5-(pyridin-2-ylamino)pent-2-enoate

Systemtic Name: ethyl (E)-3-azanyl-2-cyano-5-oxidanylidene-5-(pyridin-2-ylamino)pent-2-enoate Openeye Name: ethyl (E)-3-amino-2-cyano-5-oxo-5-(2-pyridylamino)pent-2-enoate CAS Name: (E)-3-amino-2-cyano-5-oxo-5-(2-pyridinylamino)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-3-amino-2-cyano-5-oxo-5-(pyridin-2-ylamino)pent-2-enoate Traditional Name: (E)-3-amino-2-cyano-5-keto-5-(2-pyridylamino)pent-2-enoic acid ethyl ester Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(CC(=O)NC1=CC=CC=N1)N)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\CC(=O)NC1=CC=CC=N1)/N)/C#N

InChI

InChI=1S/C13H14N4O3/c1-2-20-13(19)9(8-14)10(15)7-12(18)17-11-5-3-4-6-16-11/h3-6H,2,7,15H2,1H3,(H,16,17,18)/b10-9+