3-(2-bromophenyl)-1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]urea

Systemtic Name: 3-(2-bromophenyl)-1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]urea Openeye Name: 3-(2-bromophenyl)-1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]urea CAS Name: 3-(2-bromophenyl)-1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea IUPAC Name: 3-(2-bromophenyl)-1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea Traditional Name: 3-(2-bromophenyl)-1-butyl-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]urea Formula: C23H28BrN3O2 MolecularWeight: 458.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC=CC=C3Br

Isomeric SMILES

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C23H28BrN3O2/c1-3-4-14-26(23(29)25-21-12-8-7-11-20(21)24)16-22(28)27-15-13-18-9-5-6-10-19(18)17(27)2/h5-12,17H,3-4,13-16H2,1-2H3,(H,25,29)