N-tert-butyl-4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-(methoxymethyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-(methoxymethyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-tert-butyl-4-[5-[(2-chloro-6-fluoro-phenyl)methyl]-6-(methoxymethyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-(methoxymethyl)-2-methyl-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-tert-butyl-4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-(methoxymethyl)-2-methylpyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-tert-butyl-4-[5-(2-chloro-6-fluoro-benzyl)-6-(methoxymethyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide Formula: C23H31ClFN5O2 MolecularWeight: 463.975943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)N2CCN(CC2)C(=O)NC(C)(C)C)CC3=C(C=CC=C3Cl)F)COC

Isomeric SMILES

CC1=NC(=C(C(=N1)N2CCN(CC2)C(=O)NC(C)(C)C)CC3=C(C=CC=C3Cl)F)COC

InChI

InChI=1S/C23H31ClFN5O2/c1-15-26-20(14-32-5)17(13-16-18(24)7-6-8-19(16)25)21(27-15)29-9-11-30(12-10-29)22(31)28-23(2,3)4/h6-8H,9-14H2,1-5H3,(H,28,31)