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

Systemtic Name: 3-(4-bromanyl-2-methyl-phenyl)-1-(2-cyanoethyl)-1-methyl-urea Openeye Name: 3-(4-bromo-2-methyl-phenyl)-1-(2-cyanoethyl)-1-methyl-urea CAS Name: 3-(4-bromo-2-methylphenyl)-1-(2-cyanoethyl)-1-methylurea IUPAC Name: 3-(4-bromo-2-methylphenyl)-1-(2-cyanoethyl)-1-methylurea Traditional Name: 3-(4-bromo-2-methyl-phenyl)-1-(2-cyanoethyl)-1-methyl-urea Formula: C12H14BrN3O MolecularWeight: 296.16306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)N(C)CCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)N(C)CCC#N

InChI

InChI=1S/C12H14BrN3O/c1-9-8-10(13)4-5-11(9)15-12(17)16(2)7-3-6-14/h4-5,8H,3,7H2,1-2H3,(H,15,17)