hexyl (2S)-4-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)butanoylamino]pentanoate

Systemtic Name: hexyl (2S)-4-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)butanoylamino]pentanoate Openeye Name: hexyl (2S)-4-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)butanoylamino]pentanoate CAS Name: (2S)-4-methyl-2-[[4-(2-methyl-1-imidazo[4,5-c]pyridinyl)-1-oxobutyl]amino]pentanoic acid hexyl ester IUPAC Name: hexyl (2S)-4-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)butanoylamino]pentanoate Traditional Name: (2S)-4-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)butanoylamino]valeric acid hexyl ester Formula: C23H36N4O3 MolecularWeight: 416.55694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(CC(C)C)NC(=O)CCCN1C(=NC2=C1C=CN=C2)C

Isomeric SMILES

CCCCCCOC(=O)[C@H](CC(C)C)NC(=O)CCCN1C(=NC2=C1C=CN=C2)C

InChI

InChI=1S/C23H36N4O3/c1-5-6-7-8-14-30-23(29)19(15-17(2)3)26-22(28)10-9-13-27-18(4)25-20-16-24-12-11-21(20)27/h11-12,16-17,19H,5-10,13-15H2,1-4H3,(H,26,28)/t19-/m0/s1