N-(2,3-dimethylphenyl)-4-(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-4-(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(2,3-dimethylphenyl)-4-[2-methyl-6-(1-pyrazolyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-4-(2-methyl-6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-4-(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)piperazine-1-carboxamide Formula: C21H25N7O MolecularWeight: 391.4695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4C=CC=N4)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4C=CC=N4)C)C

InChI

InChI=1S/C21H25N7O/c1-15-6-4-7-18(16(15)2)25-21(29)27-12-10-26(11-13-27)19-14-20(24-17(3)23-19)28-9-5-8-22-28/h4-9,14H,10-13H2,1-3H3,(H,25,29)