N-(4-bromanyl-3-methyl-phenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-(2,5,6-trimethyl-4-furo[2,3-d]pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)nipecotamide Formula: C22H25BrN4O2 MolecularWeight: 457.3635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CCCN(C2)C3=C4C(=C(OC4=NC(=N3)C)C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CCCN(C2)C3=C4C(=C(OC4=NC(=N3)C)C)C)Br

InChI

InChI=1S/C22H25BrN4O2/c1-12-10-17(7-8-18(12)23)26-21(28)16-6-5-9-27(11-16)20-19-13(2)14(3)29-22(19)25-15(4)24-20/h7-8,10,16H,5-6,9,11H2,1-4H3,(H,26,28)