2-[3-[4-(5-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]propylamino]pyrimidine-4-carboxamide

Systemtic Name: 2-[3-[4-(5-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]propylamino]pyrimidine-4-carboxamide Openeye Name: 2-[3-[4-(5-fluoro-2-methoxy-phenyl)piperazin-1-yl]propylamino]pyrimidine-4-carboxamide CAS Name: 2-[3-[4-(5-fluoro-2-methoxyphenyl)-1-piperazinyl]propylamino]-4-pyrimidinecarboxamide IUPAC Name: 2-[3-[4-(5-fluoro-2-methoxyphenyl)piperazin-1-yl]propylamino]pyrimidine-4-carboxamide Traditional Name: 2-[3-[4-(5-fluoro-2-methoxy-phenyl)piperazino]propylamino]pyrimidine-4-carboxamide Formula: C19H25FN6O2 MolecularWeight: 388.439203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)N2CCN(CC2)CCCNC3=NC=CC(=N3)C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)F)N2CCN(CC2)CCCNC3=NC=CC(=N3)C(=O)N

InChI

InChI=1S/C19H25FN6O2/c1-28-17-4-3-14(20)13-16(17)26-11-9-25(10-12-26)8-2-6-22-19-23-7-5-15(24-19)18(21)27/h3-5,7,13H,2,6,8-12H2,1H3,(H2,21,27)(H,22,23,24)