1-[3-[2-cyano-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]propyl]-1-methyl-urea

Systemtic Name: 1-[3-[2-cyano-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]propyl]-1-methyl-urea Openeye Name: 1-[3-[2-cyano-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]propyl]-1-methyl-urea CAS Name: 1-[3-[2-cyano-6-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]propyl]-1-methylurea IUPAC Name: 1-[3-[2-cyano-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]propyl]-1-methylurea Traditional Name: 1-[3-[2-cyano-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]propyl]-1-methyl-urea Formula: C17H16F3N5O MolecularWeight: 363.33705

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=NC(=NC(=C1)C2=CC(=CC=C2)C(F)(F)F)C#N)C(=O)N

Isomeric SMILES

CN(CCCC1=NC(=NC(=C1)C2=CC(=CC=C2)C(F)(F)F)C#N)C(=O)N

InChI

InChI=1S/C17H16F3N5O/c1-25(16(22)26)7-3-6-13-9-14(24-15(10-21)23-13)11-4-2-5-12(8-11)17(18,19)20/h2,4-5,8-9H,3,6-7H2,1H3,(H2,22,26)