1-[3-[2,3-bis(trifluoromethyl)phenyl]-1,6-naphthyridin-2-yl]-3-methyl-urea

Systemtic Name: 1-[3-[2,3-bis(trifluoromethyl)phenyl]-1,6-naphthyridin-2-yl]-3-methyl-urea Openeye Name: 1-[3-[2,3-bis(trifluoromethyl)phenyl]-1,6-naphthyridin-2-yl]-3-methyl-urea CAS Name: 1-[3-[2,3-bis(trifluoromethyl)phenyl]-1,6-naphthyridin-2-yl]-3-methylurea IUPAC Name: 1-[3-[2,3-bis(trifluoromethyl)phenyl]-1,6-naphthyridin-2-yl]-3-methylurea Traditional Name: 1-[3-[2,3-bis(trifluoromethyl)phenyl]-1,6-naphthyridin-2-yl]-3-methyl-urea Formula: C18H12F6N4O MolecularWeight: 414.304499

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=C(C=C2C=NC=CC2=N1)C3=C(C(=CC=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CNC(=O)NC1=C(C=C2C=NC=CC2=N1)C3=C(C(=CC=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H12F6N4O/c1-25-16(29)28-15-11(7-9-8-26-6-5-13(9)27-15)10-3-2-4-12(17(19,20)21)14(10)18(22,23)24/h2-8H,1H3,(H2,25,27,28,29)