1-(2-cyanoethyl)-3-(3-fluoranyl-4-methyl-phenyl)-1-methyl-urea

Systemtic Name: 1-(2-cyanoethyl)-3-(3-fluoranyl-4-methyl-phenyl)-1-methyl-urea Openeye Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methyl-phenyl)-1-methyl-urea CAS Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methylphenyl)-1-methylurea IUPAC Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methylphenyl)-1-methylurea Traditional Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methyl-phenyl)-1-methyl-urea Formula: C12H14FN3O MolecularWeight: 235.257463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(C)CCC#N)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(C)CCC#N)F

InChI

InChI=1S/C12H14FN3O/c1-9-4-5-10(8-11(9)13)15-12(17)16(2)7-3-6-14/h4-5,8H,3,7H2,1-2H3,(H,15,17)