tert-butyl 7-[[3,3-dimethyl-1-oxidanylidene-1-(pyridin-2-ylamino)butan-2-yl]amino]-5-methyl-7-oxidanylidene-2-prop-1-en-2-yl-heptanoate

Systemtic Name: tert-butyl 7-[[3,3-dimethyl-1-oxidanylidene-1-(pyridin-2-ylamino)butan-2-yl]amino]-5-methyl-7-oxidanylidene-2-prop-1-en-2-yl-heptanoate Openeye Name: tert-butyl 7-[[2,2-dimethyl-1-(2-pyridylcarbamoyl)propyl]amino]-2-isopropenyl-5-methyl-7-oxo-heptanoate CAS Name: 7-[[3,3-dimethyl-1-oxo-1-(2-pyridinylamino)butan-2-yl]amino]-5-methyl-2-(1-methylethenyl)-7-oxoheptanoic acid tert-butyl ester IUPAC Name: tert-butyl 7-[[3,3-dimethyl-1-oxo-1-(pyridin-2-ylamino)butan-2-yl]amino]-5-methyl-7-oxo-2-prop-1-en-2-ylheptanoate Traditional Name: 2-[5-[[2,2-dimethyl-1-(2-pyridylcarbamoyl)propyl]amino]-5-keto-3-methyl-pentyl]-3-methyl-but-3-enoic acid tert-butyl ester Formula: C26H41N3O4 MolecularWeight: 459.62144

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C(=C)C)C(=O)OC(C)(C)C)CC(=O)NC(C(=O)NC1=CC=CC=N1)C(C)(C)C

Isomeric SMILES

CC(CCC(C(=C)C)C(=O)OC(C)(C)C)CC(=O)NC(C(=O)NC1=CC=CC=N1)C(C)(C)C

InChI

InChI=1S/C26H41N3O4/c1-17(2)19(24(32)33-26(7,8)9)14-13-18(3)16-21(30)29-22(25(4,5)6)23(31)28-20-12-10-11-15-27-20/h10-12,15,18-19,22H,1,13-14,16H2,2-9H3,(H,29,30)(H,27,28,31)