N-(cyanomethyl)-4-methyl-2-[4-(pyridin-4-ylcarbamoylamino)phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[4-(pyridin-4-ylcarbamoylamino)phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[4-(4-pyridylcarbamoylamino)phenyl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[4-[[oxo-(pyridin-4-ylamino)methyl]amino]phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[4-(pyridin-4-ylcarbamoylamino)phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[4-(4-pyridylcarbamoylamino)phenyl]valeramide Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)NC(=O)NC2=CC=NC=C2)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)NC(=O)NC2=CC=NC=C2)C(=O)NCC#N

InChI

InChI=1S/C20H23N5O2/c1-14(2)13-18(19(26)23-12-9-21)15-3-5-16(6-4-15)24-20(27)25-17-7-10-22-11-8-17/h3-8,10-11,14,18H,12-13H2,1-2H3,(H,23,26)(H2,22,24,25,27)