1-(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-(2-amino-6-morpholino-pyrimidin-4-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[2-amino-6-(4-morpholinyl)-4-pyrimidinyl]-N-(3-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(2-amino-6-morpholino-pyrimidin-4-yl)-N-(3-methoxyphenyl)isonipecotamide Formula: C21H28N6O3 MolecularWeight: 412.48542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)N4CCOCC4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)N4CCOCC4

InChI

InChI=1S/C21H28N6O3/c1-29-17-4-2-3-16(13-17)23-20(28)15-5-7-26(8-6-15)18-14-19(25-21(22)24-18)27-9-11-30-12-10-27/h2-4,13-15H,5-12H2,1H3,(H,23,28)(H2,22,24,25)