N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-[6-(1-pyrazolyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Formula: C20H22ClN7O3 MolecularWeight: 443.88678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)N2CCN(CC2)C3=NC=NC(=C3)N4C=CC=N4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)N2CCN(CC2)C3=NC=NC(=C3)N4C=CC=N4)Cl)OC

InChI

InChI=1S/C20H22ClN7O3/c1-30-16-11-17(31-2)15(10-14(16)21)25-20(29)27-8-6-26(7-9-27)18-12-19(23-13-22-18)28-5-3-4-24-28/h3-5,10-13H,6-9H2,1-2H3,(H,25,29)