6-[4-(4-fluorophenyl)piperazin-1-yl]-N4-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(4-fluorophenyl)piperazin-1-yl]-N4-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5-diamine Openeye Name: 6-[4-(4-fluorophenyl)piperazin-1-yl]-N4-(5-methylisoxazol-3-yl)pyrimidine-4,5-diamine CAS Name: 6-[4-(4-fluorophenyl)-1-piperazinyl]-N4-(5-methyl-3-isoxazolyl)pyrimidine-4,5-diamine IUPAC Name: 6-[4-(4-fluorophenyl)piperazin-1-yl]-4-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(4-fluorophenyl)piperazino]pyrimidin-4-yl]-(5-methylisoxazol-3-yl)amine Formula: C18H20FN7O MolecularWeight: 369.396103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=NO1)NC2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H20FN7O/c1-12-10-15(24-27-12)23-17-16(20)18(22-11-21-17)26-8-6-25(7-9-26)14-4-2-13(19)3-5-14/h2-5,10-11H,6-9,20H2,1H3,(H,21,22,23,24)