5-chloranyl-N-ethyl-N-prop-2-enyl-6-[2,3,6-tris(fluoranyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 5-chloranyl-N-ethyl-N-prop-2-enyl-6-[2,3,6-tris(fluoranyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine Openeye Name: N-allyl-5-chloro-N-ethyl-6-(2,3,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-chloro-N-ethyl-N-prop-2-enyl-6-(2,3,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine IUPAC Name: 5-chloro-N-ethyl-N-prop-2-enyl-6-(2,3,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine Traditional Name: allyl-[5-chloro-6-(2,3,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-ethyl-amine Formula: C16H13ClF3N5 MolecularWeight: 367.75613

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=C)C1=C(C(=NC2=NC=NN12)Cl)C3=C(C=CC(=C3F)F)F

Isomeric SMILES

CCN(CC=C)C1=C(C(=NC2=NC=NN12)Cl)C3=C(C=CC(=C3F)F)F

InChI

InChI=1S/C16H13ClF3N5/c1-3-7-24(4-2)15-12(11-9(18)5-6-10(19)13(11)20)14(17)23-16-21-8-22-25(15)16/h3,5-6,8H,1,4,7H2,2H3