N-[2-(4-fluorophenyl)ethyl]-4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-[2-(4-fluorophenyl)ethyl]-4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-[2-(4-fluorophenyl)ethyl]-4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-[2-(4-fluorophenyl)ethyl]-4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(4-fluorophenyl)ethyl]-4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-[2-(4-fluorophenyl)ethyl]-4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxamide Formula: C21H28FN5O MolecularWeight: 385.478323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)NCCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)NCCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H28FN5O/c1-15(2)20-24-16(3)14-19(25-20)26-10-12-27(13-11-26)21(28)23-9-8-17-4-6-18(22)7-5-17/h4-7,14-15H,8-13H2,1-3H3,(H,23,28)