N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-5-ylphenyl)pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-5-ylphenyl)pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-5-ylphenyl)pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-(5-pyrimidinyl)phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-(3-pyrimidin-5-ylphenyl)pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-(5-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=CN=CN=C2)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CN=CN=C2)C(=O)NCC#N

InChI

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