3-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-1-(2-cyanoethyl)-1-methyl-urea

Systemtic Name: 3-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-1-(2-cyanoethyl)-1-methyl-urea Openeye Name: 1-(2-cyanoethyl)-3-(2,6-dibromo-4-isopropyl-phenyl)-1-methyl-urea CAS Name: 1-(2-cyanoethyl)-3-(2,6-dibromo-4-propan-2-ylphenyl)-1-methylurea IUPAC Name: 1-(2-cyanoethyl)-3-(2,6-dibromo-4-propan-2-ylphenyl)-1-methylurea Traditional Name: 1-(2-cyanoethyl)-3-(2,6-dibromo-4-isopropyl-phenyl)-1-methyl-urea Formula: C14H17Br2N3O MolecularWeight: 403.11228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17Br2N3O/c1-9(2)10-7-11(15)13(12(16)8-10)18-14(20)19(3)6-4-5-17/h7-9H,4,6H2,1-3H3,(H,18,20)