3-cyclohexyl-N-(2-pyrimidin-2-yl-3H-isoindol-1-ylidene)propanamide

Systemtic Name: 3-cyclohexyl-N-(2-pyrimidin-2-yl-3H-isoindol-1-ylidene)propanamide Openeye Name: 3-cyclohexyl-N-(2-pyrimidin-2-ylisoindolin-1-ylidene)propanamide CAS Name: 3-cyclohexyl-N-[2-(2-pyrimidinyl)-3H-isoindol-1-ylidene]propanamide IUPAC Name: 3-cyclohexyl-N-(2-pyrimidin-2-yl-3H-isoindol-1-ylidene)propanamide Traditional Name: 3-cyclohexyl-N-[2-(2-pyrimidyl)isoindolin-1-ylidene]propionamide Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)N=C2C3=CC=CC=C3CN2C4=NC=CC=N4

Isomeric SMILES

C1CCC(CC1)CCC(=O)N=C2C3=CC=CC=C3CN2C4=NC=CC=N4

InChI

InChI=1S/C21H24N4O/c26-19(12-11-16-7-2-1-3-8-16)24-20-18-10-5-4-9-17(18)15-25(20)21-22-13-6-14-23-21/h4-6,9-10,13-14,16H,1-3,7-8,11-12,15H2