2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-N-(2,5-dimethylphenyl)propanamide

Systemtic Name: 2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-N-(2,5-dimethylphenyl)propanamide Openeye Name: 2-[4-(4-cyano-2-pyridyl)piperazin-1-yl]-N-(2,5-dimethylphenyl)propanamide CAS Name: 2-[4-(4-cyano-2-pyridinyl)-1-piperazinyl]-N-(2,5-dimethylphenyl)propanamide IUPAC Name: 2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-N-(2,5-dimethylphenyl)propanamide Traditional Name: 2-[4-(4-cyano-2-pyridyl)piperazino]-N-(2,5-dimethylphenyl)propionamide Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)N2CCN(CC2)C3=NC=CC(=C3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C)N2CCN(CC2)C3=NC=CC(=C3)C#N

InChI

InChI=1S/C21H25N5O/c1-15-4-5-16(2)19(12-15)24-21(27)17(3)25-8-10-26(11-9-25)20-13-18(14-22)6-7-23-20/h4-7,12-13,17H,8-11H2,1-3H3,(H,24,27)