ethyl (2S)-4-methyl-2-[7-(2-methylimidazo[4,5-c]pyridin-1-yl)heptanoylamino]pentanoate

Systemtic Name: ethyl (2S)-4-methyl-2-[7-(2-methylimidazo[4,5-c]pyridin-1-yl)heptanoylamino]pentanoate Openeye Name: ethyl (2S)-4-methyl-2-[7-(2-methylimidazo[4,5-c]pyridin-1-yl)heptanoylamino]pentanoate CAS Name: (2S)-4-methyl-2-[[7-(2-methyl-1-imidazo[4,5-c]pyridinyl)-1-oxoheptyl]amino]pentanoic acid ethyl ester IUPAC Name: ethyl (2S)-4-methyl-2-[7-(2-methylimidazo[4,5-c]pyridin-1-yl)heptanoylamino]pentanoate Traditional Name: (2S)-4-methyl-2-[7-(2-methylimidazo[4,5-c]pyridin-1-yl)heptanoylamino]valeric acid ethyl ester Formula: C22H34N4O3 MolecularWeight: 402.53036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)CCCCCCN1C(=NC2=C1C=CN=C2)C

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)NC(=O)CCCCCCN1C(=NC2=C1C=CN=C2)C

InChI

InChI=1S/C22H34N4O3/c1-5-29-22(28)18(14-16(2)3)25-21(27)10-8-6-7-9-13-26-17(4)24-19-15-23-12-11-20(19)26/h11-12,15-16,18H,5-10,13-14H2,1-4H3,(H,25,27)/t18-/m0/s1