N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-2-ylphenyl)pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-2-ylphenyl)pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-2-ylphenyl)pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-(2-pyrimidinyl)phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-2-ylphenyl)pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-(2-pyrimidyl)phenyl]valeramide Formula: C18H20N4O MolecularWeight: 308.3776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=NC=CC=N2)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=NC=CC=N2)C(=O)NCC#N

InChI

InChI=1S/C18H20N4O/c1-13(2)11-16(18(23)22-10-7-19)14-5-3-6-15(12-14)17-20-8-4-9-21-17/h3-6,8-9,12-13,16H,10-11H2,1-2H3,(H,22,23)