1-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-prop-2-ynyl-urea

Systemtic Name: 1-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-prop-2-ynyl-urea Openeye Name: 1-[(4-fluoro-3-methyl-phenyl)methyl]-3-prop-2-ynyl-urea CAS Name: 1-[(4-fluoro-3-methylphenyl)methyl]-3-prop-2-ynylurea IUPAC Name: 1-[(4-fluoro-3-methylphenyl)methyl]-3-prop-2-ynylurea Traditional Name: 1-(4-fluoro-3-methyl-benzyl)-3-propargyl-urea Formula: C12H13FN2O MolecularWeight: 220.242823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)NCC#C)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)NCC#C)F

InChI

InChI=1S/C12H13FN2O/c1-3-6-14-12(16)15-8-10-4-5-11(13)9(2)7-10/h1,4-5,7H,6,8H2,2H3,(H2,14,15,16)