4-[3-(2-cyclohexylethoxy)phenyl]carbonyl-N-pyrimidin-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[3-(2-cyclohexylethoxy)phenyl]carbonyl-N-pyrimidin-2-yl-piperazine-1-carboxamide Openeye Name: 4-[3-(2-cyclohexylethoxy)benzoyl]-N-pyrimidin-2-yl-piperazine-1-carboxamide CAS Name: 4-[[3-(2-cyclohexylethoxy)phenyl]-oxomethyl]-N-(2-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: 4-[3-(2-cyclohexylethoxy)benzoyl]-N-pyrimidin-2-ylpiperazine-1-carboxamide Traditional Name: 4-[3-(2-cyclohexylethoxy)benzoyl]-N-(2-pyrimidyl)piperazine-1-carboxamide Formula: C24H31N5O3 MolecularWeight: 437.53464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCOC2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)NC4=NC=CC=N4

Isomeric SMILES

C1CCC(CC1)CCOC2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)NC4=NC=CC=N4

InChI

InChI=1S/C24H31N5O3/c30-22(20-8-4-9-21(18-20)32-17-10-19-6-2-1-3-7-19)28-13-15-29(16-14-28)24(31)27-23-25-11-5-12-26-23/h4-5,8-9,11-12,18-19H,1-3,6-7,10,13-17H2,(H,25,26,27,31)