2-[[1-[3-(5-fluoranyl-2-methoxy-phenoxy)propyl]piperidin-4-yl]amino]pyrimidine-4-carboxamide

Systemtic Name: 2-[[1-[3-(5-fluoranyl-2-methoxy-phenoxy)propyl]piperidin-4-yl]amino]pyrimidine-4-carboxamide Openeye Name: 2-[[1-[3-(5-fluoro-2-methoxy-phenoxy)propyl]-4-piperidyl]amino]pyrimidine-4-carboxamide CAS Name: 2-[[1-[3-(5-fluoro-2-methoxyphenoxy)propyl]-4-piperidinyl]amino]-4-pyrimidinecarboxamide IUPAC Name: 2-[[1-[3-(5-fluoro-2-methoxyphenoxy)propyl]piperidin-4-yl]amino]pyrimidine-4-carboxamide Traditional Name: 2-[[1-[3-(5-fluoro-2-methoxy-phenoxy)propyl]-4-piperidyl]amino]pyrimidine-4-carboxamide Formula: C20H26FN5O3 MolecularWeight: 403.450543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)OCCCN2CCC(CC2)NC3=NC=CC(=N3)C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)F)OCCCN2CCC(CC2)NC3=NC=CC(=N3)C(=O)N

InChI

InChI=1S/C20H26FN5O3/c1-28-17-4-3-14(21)13-18(17)29-12-2-9-26-10-6-15(7-11-26)24-20-23-8-5-16(25-20)19(22)27/h3-5,8,13,15H,2,6-7,9-12H2,1H3,(H2,22,27)(H,23,24,25)