2-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methylamino]-6-phenyl-pyrimidine-4-carboxamide

Systemtic Name: 2-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methylamino]-6-phenyl-pyrimidine-4-carboxamide Openeye Name: 2-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methylamino]-6-phenyl-pyrimidine-4-carboxamide CAS Name: 2-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methylamino]-6-phenyl-4-pyrimidinecarboxamide IUPAC Name: 2-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methylamino]-6-phenylpyrimidine-4-carboxamide Traditional Name: 2-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methylamino]-6-phenyl-pyrimidine-4-carboxamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCCC2)CNC3=NC(=CC(=N3)C(=O)N)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCCC2)CNC3=NC(=CC(=N3)C(=O)N)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H28N4O3/c1-31-21-11-10-18(14-22(21)32-2)25(12-6-7-13-25)16-27-24-28-19(15-20(29-24)23(26)30)17-8-4-3-5-9-17/h3-5,8-11,14-15H,6-7,12-13,16H2,1-2H3,(H2,26,30)(H,27,28,29)