4-methyl-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]piperazine-1-carboxamide

Systemtic Name: 4-methyl-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]piperazine-1-carboxamide Openeye Name: 4-methyl-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]piperazine-1-carboxamide CAS Name: 4-methyl-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-1-piperazinecarboxamide IUPAC Name: 4-methyl-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]piperazine-1-carboxamide Traditional Name: 4-methyl-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]piperazine-1-carboxamide Formula: C22H25N7O MolecularWeight: 403.4802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C)NC3=NC=CC(=N3)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C)NC3=NC=CC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C22H25N7O/c1-16-5-6-18(25-22(30)29-12-10-28(2)11-13-29)14-20(16)27-21-24-9-7-19(26-21)17-4-3-8-23-15-17/h3-9,14-15H,10-13H2,1-2H3,(H,25,30)(H,24,26,27)