1-azanyl-4-(dimethylamino)-N-[(2-fluorophenyl)methyl]-2-(4-methylpyrimidin-2-yl)cyclohexane-1-carboxamide

Systemtic Name: 1-azanyl-4-(dimethylamino)-N-[(2-fluorophenyl)methyl]-2-(4-methylpyrimidin-2-yl)cyclohexane-1-carboxamide Openeye Name: 1-amino-4-(dimethylamino)-N-[(2-fluorophenyl)methyl]-2-(4-methylpyrimidin-2-yl)cyclohexanecarboxamide CAS Name: 1-amino-4-(dimethylamino)-N-[(2-fluorophenyl)methyl]-2-(4-methyl-2-pyrimidinyl)-1-cyclohexanecarboxamide IUPAC Name: 1-amino-4-(dimethylamino)-N-[(2-fluorophenyl)methyl]-2-(4-methylpyrimidin-2-yl)cyclohexane-1-carboxamide Traditional Name: 1-amino-4-(dimethylamino)-N-(2-fluorobenzyl)-2-(4-methylpyrimidin-2-yl)cyclohexanecarboxamide Formula: C21H28FN5O MolecularWeight: 385.478323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)C2CC(CCC2(C(=O)NCC3=CC=CC=C3F)N)N(C)C

Isomeric SMILES

CC1=NC(=NC=C1)C2CC(CCC2(C(=O)NCC3=CC=CC=C3F)N)N(C)C

InChI

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