ethyl 5-[5-methyl-2-oxidanylidene-3-[(E)-pyridin-3-ylmethylideneamino]imidazol-1-yl]pentanoate

Systemtic Name: ethyl 5-[5-methyl-2-oxidanylidene-3-[(E)-pyridin-3-ylmethylideneamino]imidazol-1-yl]pentanoate Openeye Name: ethyl 5-[5-methyl-2-oxo-3-[(E)-3-pyridylmethyleneamino]imidazol-1-yl]pentanoate CAS Name: 5-[5-methyl-2-oxo-3-[(E)-3-pyridinylmethylideneamino]-1-imidazolyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[5-methyl-2-oxo-3-[(E)-pyridin-3-ylmethylideneamino]imidazol-1-yl]pentanoate Traditional Name: 5-[2-keto-5-methyl-3-[(E)-3-pyridylmethyleneamino]-4-imidazolin-1-yl]valeric acid ethyl ester Formula: C17H22N4O3 MolecularWeight: 330.38158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C(=CN(C1=O)N=CC2=CN=CC=C2)C

Isomeric SMILES

CCOC(=O)CCCCN1C(=CN(C1=O)/N=C/C2=CN=CC=C2)C

InChI

InChI=1S/C17H22N4O3/c1-3-24-16(22)8-4-5-10-20-14(2)13-21(17(20)23)19-12-15-7-6-9-18-11-15/h6-7,9,11-13H,3-5,8,10H2,1-2H3/b19-12+