N-(3-chloranyl-2-methyl-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-4-[6-(1-pyrazolyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-(6-pyrazol-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Formula: C19H20ClN7O MolecularWeight: 397.8614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)N2CCN(CC2)C3=NC=NC(=C3)N4C=CC=N4

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)N2CCN(CC2)C3=NC=NC(=C3)N4C=CC=N4

InChI

InChI=1S/C19H20ClN7O/c1-14-15(20)4-2-5-16(14)24-19(28)26-10-8-25(9-11-26)17-12-18(22-13-21-17)27-7-3-6-23-27/h2-7,12-13H,8-11H2,1H3,(H,24,28)