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

Systemtic Name: 3-(3-bromophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1-pentyl-urea Openeye Name: 3-(3-bromophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-1-pentyl-urea CAS Name: 3-(3-bromophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1-pentylurea IUPAC Name: 3-(3-bromophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1-pentylurea Traditional Name: 1-amyl-3-(3-bromophenyl)-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]urea Formula: C24H30BrN3O2 MolecularWeight: 472.4179

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C24H30BrN3O2/c1-3-4-7-14-27(24(30)26-21-11-8-10-20(25)16-21)17-23(29)28-15-13-19-9-5-6-12-22(19)18(28)2/h5-6,8-12,16,18H,3-4,7,13-15,17H2,1-2H3,(H,26,30)