ethyl (2S)-4-methyl-2-[6-(2-methylimidazo[4,5-c]pyridin-1-yl)hexanoylamino]pentanoate

Systemtic Name: ethyl (2S)-4-methyl-2-[6-(2-methylimidazo[4,5-c]pyridin-1-yl)hexanoylamino]pentanoate Openeye Name: ethyl (2S)-4-methyl-2-[6-(2-methylimidazo[4,5-c]pyridin-1-yl)hexanoylamino]pentanoate CAS Name: (2S)-4-methyl-2-[[6-(2-methyl-1-imidazo[4,5-c]pyridinyl)-1-oxohexyl]amino]pentanoic acid ethyl ester IUPAC Name: ethyl (2S)-4-methyl-2-[6-(2-methylimidazo[4,5-c]pyridin-1-yl)hexanoylamino]pentanoate Traditional Name: (2S)-4-methyl-2-[6-(2-methylimidazo[4,5-c]pyridin-1-yl)hexanoylamino]valeric acid ethyl ester Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)CCCCCN1C(=NC2=C1C=CN=C2)C

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)NC(=O)CCCCCN1C(=NC2=C1C=CN=C2)C

InChI

InChI=1S/C21H32N4O3/c1-5-28-21(27)17(13-15(2)3)24-20(26)9-7-6-8-12-25-16(4)23-18-14-22-11-10-19(18)25/h10-11,14-15,17H,5-9,12-13H2,1-4H3,(H,24,26)/t17-/m0/s1