2-azanyl-6-[4-(5-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]-5-(2-oxidanylpropyl)pyrimidine-4-carboxamide

Systemtic Name: 2-azanyl-6-[4-(5-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]-5-(2-oxidanylpropyl)pyrimidine-4-carboxamide Openeye Name: 2-amino-6-[4-(5-fluoro-2-methoxy-phenyl)piperazin-1-yl]-5-(2-hydroxypropyl)pyrimidine-4-carboxamide CAS Name: 2-amino-6-[4-(5-fluoro-2-methoxyphenyl)-1-piperazinyl]-5-(2-hydroxypropyl)-4-pyrimidinecarboxamide IUPAC Name: 2-amino-6-[4-(5-fluoro-2-methoxyphenyl)piperazin-1-yl]-5-(2-hydroxypropyl)pyrimidine-4-carboxamide Traditional Name: 2-amino-6-[4-(5-fluoro-2-methoxy-phenyl)piperazino]-5-(2-hydroxypropyl)pyrimidine-4-carboxamide Formula: C19H25FN6O3 MolecularWeight: 404.438603

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(N=C(N=C1N2CCN(CC2)C3=C(C=CC(=C3)F)OC)N)C(=O)N)O

Isomeric SMILES

CC(CC1=C(N=C(N=C1N2CCN(CC2)C3=C(C=CC(=C3)F)OC)N)C(=O)N)O

InChI

InChI=1S/C19H25FN6O3/c1-11(27)9-13-16(17(21)28)23-19(22)24-18(13)26-7-5-25(6-8-26)14-10-12(20)3-4-15(14)29-2/h3-4,10-11,27H,5-9H2,1-2H3,(H2,21,28)(H2,22,23,24)