N-[[2-cyano-4-(2-methylpropylamino)pyrimidin-5-yl]methyl]-4-[1-(2-methoxyethyl)piperidin-4-yl]benzamide

Systemtic Name: N-[[2-cyano-4-(2-methylpropylamino)pyrimidin-5-yl]methyl]-4-[1-(2-methoxyethyl)piperidin-4-yl]benzamide Openeye Name: N-[[2-cyano-4-(isobutylamino)pyrimidin-5-yl]methyl]-4-[1-(2-methoxyethyl)-4-piperidyl]benzamide CAS Name: N-[[2-cyano-4-(2-methylpropylamino)-5-pyrimidinyl]methyl]-4-[1-(2-methoxyethyl)-4-piperidinyl]benzamide IUPAC Name: N-[[2-cyano-4-(2-methylpropylamino)pyrimidin-5-yl]methyl]-4-[1-(2-methoxyethyl)piperidin-4-yl]benzamide Traditional Name: N-[[2-cyano-4-(isobutylamino)pyrimidin-5-yl]methyl]-4-[1-(2-methoxyethyl)-4-piperidyl]benzamide Formula: C25H34N6O2 MolecularWeight: 450.57646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC=C1CNC(=O)C2=CC=C(C=C2)C3CCN(CC3)CCOC)C#N

Isomeric SMILES

CC(C)CNC1=NC(=NC=C1CNC(=O)C2=CC=C(C=C2)C3CCN(CC3)CCOC)C#N

InChI

InChI=1S/C25H34N6O2/c1-18(2)15-28-24-22(16-27-23(14-26)30-24)17-29-25(32)21-6-4-19(5-7-21)20-8-10-31(11-9-20)12-13-33-3/h4-7,16,18,20H,8-13,15,17H2,1-3H3,(H,29,32)(H,27,28,30)