4-[[3-chloranyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-[[3-chloranyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-[[3-chloro-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-[[3-chloro-5-[[4-(2-phenyl-3-pyrazolyl)-2-pyrimidinyl]amino]phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-[[3-chloro-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-[3-chloro-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]benzyl]piperazine-1-carboxamide Formula: C25H25ClN8O MolecularWeight: 488.972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC(=C2)Cl)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5)C(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC(=C2)Cl)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C25H25ClN8O/c26-19-14-18(17-32-10-12-33(13-11-32)24(27)35)15-20(16-19)30-25-28-8-6-22(31-25)23-7-9-29-34(23)21-4-2-1-3-5-21/h1-9,14-16H,10-13,17H2,(H2,27,35)(H,28,30,31)