(2S)-2-[(6-butyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-ethoxypropyl)-4-methyl-pentanamide

Systemtic Name: (2S)-2-[(6-butyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-ethoxypropyl)-4-methyl-pentanamide Openeye Name: (2S)-2-[(6-butyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-ethoxypropyl)-4-methyl-pentanamide CAS Name: (2S)-2-[[6-butyl-2-(1-imidazolyl)-4-pyrimidinyl]amino]-N-(3-ethoxypropyl)-4-methylpentanamide IUPAC Name: (2S)-2-[(6-butyl-2-imidazol-1-ylpyrimidin-4-yl)amino]-N-(3-ethoxypropyl)-4-methylpentanamide Traditional Name: (2S)-2-[(6-butyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-ethoxypropyl)-4-methyl-valeramide Formula: C22H36N6O2 MolecularWeight: 416.56024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=NC(=N1)N2C=CN=C2)NC(CC(C)C)C(=O)NCCCOCC

Isomeric SMILES

CCCCC1=CC(=NC(=N1)N2C=CN=C2)N[C@@H](CC(C)C)C(=O)NCCCOCC

InChI

InChI=1S/C22H36N6O2/c1-5-7-9-18-15-20(27-22(25-18)28-12-11-23-16-28)26-19(14-17(3)4)21(29)24-10-8-13-30-6-2/h11-12,15-17,19H,5-10,13-14H2,1-4H3,(H,24,29)(H,25,26,27)/t19-/m0/s1