4-[3-(2-cyclohexylethoxy)phenyl]carbonyl-N-pyrimidin-5-yl-piperazine-1-carboxamide

Systemtic Name: 4-[3-(2-cyclohexylethoxy)phenyl]carbonyl-N-pyrimidin-5-yl-piperazine-1-carboxamide Openeye Name: 4-[3-(2-cyclohexylethoxy)benzoyl]-N-pyrimidin-5-yl-piperazine-1-carboxamide CAS Name: 4-[[3-(2-cyclohexylethoxy)phenyl]-oxomethyl]-N-(5-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: 4-[3-(2-cyclohexylethoxy)benzoyl]-N-pyrimidin-5-ylpiperazine-1-carboxamide Traditional Name: 4-[3-(2-cyclohexylethoxy)benzoyl]-N-(5-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=CN=CN=C4

Isomeric SMILES

C1CCC(CC1)CCOC2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)NC4=CN=CN=C4

InChI

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