N-[(2,5-dimethylphenyl)methyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-pyridin-3-ylcarbonyl-piperazine-2-carboxamide

Systemtic Name: N-[(2,5-dimethylphenyl)methyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-pyridin-3-ylcarbonyl-piperazine-2-carboxamide Openeye Name: N-[(2,5-dimethylphenyl)methyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(pyridine-3-carbonyl)piperazine-2-carboxamide CAS Name: N-[(2,5-dimethylphenyl)methyl]-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-4-[oxo(3-pyridinyl)methyl]-2-piperazinecarboxamide IUPAC Name: N-[(2,5-dimethylphenyl)methyl]-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-4-(pyridine-3-carbonyl)piperazine-2-carboxamide Traditional Name: N-(2,5-dimethylbenzyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-nicotinoyl-piperazine-2-carboxamide Formula: C28H30N8O2 MolecularWeight: 510.5902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC(=O)C2CN(CCN2C3=NC(=NC(=C3)C)N4C=CN=C4)C(=O)C5=CN=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC(=O)C2CN(CCN2C3=NC(=NC(=C3)C)N4C=CN=C4)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C28H30N8O2/c1-19-6-7-20(2)23(13-19)16-31-26(37)24-17-34(27(38)22-5-4-8-29-15-22)11-12-36(24)25-14-21(3)32-28(33-25)35-10-9-30-18-35/h4-10,13-15,18,24H,11-12,16-17H2,1-3H3,(H,31,37)