5-[(E)-2-(3-fluoranyl-4-methyl-phenyl)ethenyl]pyrimidine-4,6-diamine

Systemtic Name: 5-[(E)-2-(3-fluoranyl-4-methyl-phenyl)ethenyl]pyrimidine-4,6-diamine Openeye Name: 5-[(E)-2-(3-fluoro-4-methyl-phenyl)vinyl]pyrimidine-4,6-diamine CAS Name: 5-[(E)-2-(3-fluoro-4-methylphenyl)ethenyl]pyrimidine-4,6-diamine IUPAC Name: 5-[(E)-2-(3-fluoro-4-methylphenyl)ethenyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-5-[(E)-2-(3-fluoro-4-methyl-phenyl)vinyl]pyrimidin-4-yl]amine Formula: C13H13FN4 MolecularWeight: 244.267523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC2=C(N=CN=C2N)N)F

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C2=C(N=CN=C2N)N)F

InChI

InChI=1S/C13H13FN4/c1-8-2-3-9(6-11(8)14)4-5-10-12(15)17-7-18-13(10)16/h2-7H,1H3,(H4,15,16,17,18)/b5-4+