N-[1-(3,4-dichlorophenyl)pyrazol-4-yl]-4-(pyrimidin-4-ylamino)benzamide

Systemtic Name: N-[1-(3,4-dichlorophenyl)pyrazol-4-yl]-4-(pyrimidin-4-ylamino)benzamide Openeye Name: N-[1-(3,4-dichlorophenyl)pyrazol-4-yl]-4-(pyrimidin-4-ylamino)benzamide CAS Name: N-[1-(3,4-dichlorophenyl)-4-pyrazolyl]-4-(4-pyrimidinylamino)benzamide IUPAC Name: N-[1-(3,4-dichlorophenyl)pyrazol-4-yl]-4-(pyrimidin-4-ylamino)benzamide Traditional Name: N-[1-(3,4-dichlorophenyl)pyrazol-4-yl]-4-(4-pyrimidylamino)benzamide Formula: C20H14Cl2N6O MolecularWeight: 425.27076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CN(N=C2)C3=CC(=C(C=C3)Cl)Cl)NC4=NC=NC=C4

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CN(N=C2)C3=CC(=C(C=C3)Cl)Cl)NC4=NC=NC=C4

InChI

InChI=1S/C20H14Cl2N6O/c21-17-6-5-16(9-18(17)22)28-11-15(10-25-28)27-20(29)13-1-3-14(4-2-13)26-19-7-8-23-12-24-19/h1-12H,(H,27,29)(H,23,24,26)