N-[4-methyl-3-[(4-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-4-propyl-benzamide

Systemtic Name: N-[4-methyl-3-[(4-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-4-propyl-benzamide Openeye Name: N-[4-methyl-3-[(4-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-4-propyl-benzamide CAS Name: N-[4-methyl-3-[[4-(5-pyrimidinyl)-2-pyrimidinyl]amino]phenyl]-4-propylbenzamide IUPAC Name: N-[4-methyl-3-[(4-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-4-propylbenzamide Traditional Name: N-[4-methyl-3-[[4-(5-pyrimidyl)pyrimidin-2-yl]amino]phenyl]-4-propyl-benzamide Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)NC3=NC=CC(=N3)C4=CN=CN=C4

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)NC3=NC=CC(=N3)C4=CN=CN=C4

InChI

InChI=1S/C25H24N6O/c1-3-4-18-6-8-19(9-7-18)24(32)29-21-10-5-17(2)23(13-21)31-25-28-12-11-22(30-25)20-14-26-16-27-15-20/h5-16H,3-4H2,1-2H3,(H,29,32)(H,28,30,31)