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

Systemtic Name: 3-(4-bromanyl-2-methyl-phenyl)-1-(2-cyanoethyl)-1-(oxolan-2-ylmethyl)urea Openeye Name: 3-(4-bromo-2-methyl-phenyl)-1-(2-cyanoethyl)-1-(tetrahydrofuran-2-ylmethyl)urea CAS Name: 3-(4-bromo-2-methylphenyl)-1-(2-cyanoethyl)-1-(2-oxolanylmethyl)urea IUPAC Name: 3-(4-bromo-2-methylphenyl)-1-(2-cyanoethyl)-1-(oxolan-2-ylmethyl)urea Traditional Name: 3-(4-bromo-2-methyl-phenyl)-1-(2-cyanoethyl)-1-(tetrahydrofurfuryl)urea Formula: C16H20BrN3O2 MolecularWeight: 366.2529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)N(CCC#N)CC2CCCO2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)N(CCC#N)CC2CCCO2

InChI

InChI=1S/C16H20BrN3O2/c1-12-10-13(17)5-6-15(12)19-16(21)20(8-3-7-18)11-14-4-2-9-22-14/h5-6,10,14H,2-4,8-9,11H2,1H3,(H,19,21)