prop-2-enyl (2S)-2-[5-(2-methylimidazo[4,5-c]pyridin-1-yl)pentanoylamino]hexanoate

Systemtic Name: prop-2-enyl (2S)-2-[5-(2-methylimidazo[4,5-c]pyridin-1-yl)pentanoylamino]hexanoate Openeye Name: allyl (2S)-2-[5-(2-methylimidazo[4,5-c]pyridin-1-yl)pentanoylamino]hexanoate CAS Name: (2S)-2-[[5-(2-methyl-1-imidazo[4,5-c]pyridinyl)-1-oxopentyl]amino]hexanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S)-2-[5-(2-methylimidazo[4,5-c]pyridin-1-yl)pentanoylamino]hexanoate Traditional Name: (2S)-2-[5-(2-methylimidazo[4,5-c]pyridin-1-yl)pentanoylamino]hexanoic acid allyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC=C)NC(=O)CCCCN1C(=NC2=C1C=CN=C2)C

Isomeric SMILES

CCCC[C@@H](C(=O)OCC=C)NC(=O)CCCCN1C(=NC2=C1C=CN=C2)C

InChI

InChI=1S/C21H30N4O3/c1-4-6-9-17(21(27)28-14-5-2)24-20(26)10-7-8-13-25-16(3)23-18-15-22-12-11-19(18)25/h5,11-12,15,17H,2,4,6-10,13-14H2,1,3H3,(H,24,26)/t17-/m0/s1