(2S)-N-(cyanomethyl)-2-[[2-[4-(2-hydroxyethyl)piperidin-1-yl]pyrimidin-4-yl]amino]-4-methyl-pentanamide

Systemtic Name: (2S)-N-(cyanomethyl)-2-[[2-[4-(2-hydroxyethyl)piperidin-1-yl]pyrimidin-4-yl]amino]-4-methyl-pentanamide Openeye Name: (2S)-N-(cyanomethyl)-2-[[2-[4-(2-hydroxyethyl)-1-piperidyl]pyrimidin-4-yl]amino]-4-methyl-pentanamide CAS Name: (2S)-N-(cyanomethyl)-2-[[2-[4-(2-hydroxyethyl)-1-piperidinyl]-4-pyrimidinyl]amino]-4-methylpentanamide IUPAC Name: (2S)-N-(cyanomethyl)-2-[[2-[4-(2-hydroxyethyl)piperidin-1-yl]pyrimidin-4-yl]amino]-4-methylpentanamide Traditional Name: (2S)-N-(cyanomethyl)-2-[[2-[4-(2-hydroxyethyl)piperidino]pyrimidin-4-yl]amino]-4-methyl-valeramide Formula: C19H30N6O2 MolecularWeight: 374.4805

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC1=NC(=NC=C1)N2CCC(CC2)CCO

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC#N)NC1=NC(=NC=C1)N2CCC(CC2)CCO

InChI

InChI=1S/C19H30N6O2/c1-14(2)13-16(18(27)21-9-7-20)23-17-3-8-22-19(24-17)25-10-4-15(5-11-25)6-12-26/h3,8,14-16,26H,4-6,9-13H2,1-2H3,(H,21,27)(H,22,23,24)/t16-/m0/s1