methyl 2-[[4-[3-(3-imidazol-1-ylpropylcarbamoyl)-6-methyl-pyridin-2-yl]piperidin-1-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[4-[3-(3-imidazol-1-ylpropylcarbamoyl)-6-methyl-pyridin-2-yl]piperidin-1-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[4-[3-(3-imidazol-1-ylpropylcarbamoyl)-6-methyl-2-pyridyl]piperidine-1-carbonyl]amino]-4-methyl-pentanoate CAS Name: 2-[[[4-[3-[[3-(1-imidazolyl)propylamino]-oxomethyl]-6-methyl-2-pyridinyl]-1-piperidinyl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[4-[3-(3-imidazol-1-ylpropylcarbamoyl)-6-methylpyridin-2-yl]piperidine-1-carbonyl]amino]-4-methylpentanoate Traditional Name: 2-[[4-[3-(3-imidazol-1-ylpropylcarbamoyl)-6-methyl-2-pyridyl]piperidine-1-carbonyl]amino]-4-methyl-valeric acid methyl ester Formula: C26H38N6O4 MolecularWeight: 498.61772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)NC(CC(C)C)C(=O)OC

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)NC(CC(C)C)C(=O)OC

InChI

InChI=1S/C26H38N6O4/c1-18(2)16-22(25(34)36-4)30-26(35)32-13-8-20(9-14-32)23-21(7-6-19(3)29-23)24(33)28-10-5-12-31-15-11-27-17-31/h6-7,11,15,17-18,20,22H,5,8-10,12-14,16H2,1-4H3,(H,28,33)(H,30,35)