4-(7-methoxy-1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine

Systemtic Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine Openeye Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine CAS Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine Traditional Name: [4-(7-methoxy-1,3-benzodioxol-5-yl)pyrimidin-2-yl]-[3-(trifluoromethyl)phenyl]amine Formula: C19H14F3N3O3 MolecularWeight: 389.32797

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C3=NC(=NC=C3)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C3=NC(=NC=C3)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C19H14F3N3O3/c1-26-15-7-11(8-16-17(15)28-10-27-16)14-5-6-23-18(25-14)24-13-4-2-3-12(9-13)19(20,21)22/h2-9H,10H2,1H3,(H,23,24,25)