5-chloranyl-N-(3-fluoranyl-4-methyl-phenyl)-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(3-fluoranyl-4-methyl-phenyl)-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(3-fluoro-4-methyl-phenyl)-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(3-fluoro-4-methylphenyl)-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(3-fluoro-4-methylphenyl)-2-pyrrolidin-1-ylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(3-fluoro-4-methyl-phenyl)-2-pyrrolidino-pyrimidine-4-carboxamide Formula: C16H16ClFN4O MolecularWeight: 334.775843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)N3CCCC3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)N3CCCC3)F

InChI

InChI=1S/C16H16ClFN4O/c1-10-4-5-11(8-13(10)18)20-15(23)14-12(17)9-19-16(21-14)22-6-2-3-7-22/h4-5,8-9H,2-3,6-7H2,1H3,(H,20,23)