N-butan-2-yl-4-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)pyrimidine-5-carboxamide

Systemtic Name: N-butan-2-yl-4-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)pyrimidine-5-carboxamide Openeye Name: 4-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)-N-sec-butyl-pyrimidine-5-carboxamide CAS Name: N-butan-2-yl-4-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)-5-pyrimidinecarboxamide IUPAC Name: N-butan-2-yl-4-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)pyrimidine-5-carboxamide Traditional Name: 4-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)-N-sec-butyl-pyrimidine-5-carboxamide Formula: C22H29FN4O MolecularWeight: 384.490263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CN=C(N=C1N(C)C2CCCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)NC(=O)C1=CN=C(N=C1N(C)C2CCCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H29FN4O/c1-4-15(2)25-22(28)19-14-24-20(16-10-12-17(23)13-11-16)26-21(19)27(3)18-8-6-5-7-9-18/h10-15,18H,4-9H2,1-3H3,(H,25,28)