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

Systemtic Name: 3-(3,4-dichlorophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1-pentyl-urea Openeye Name: 3-(3,4-dichlorophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-1-pentyl-urea CAS Name: 3-(3,4-dichlorophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1-pentylurea IUPAC Name: 3-(3,4-dichlorophenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1-pentylurea Traditional Name: 1-amyl-3-(3,4-dichlorophenyl)-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]urea Formula: C24H29Cl2N3O2 MolecularWeight: 462.41196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29Cl2N3O2/c1-3-4-7-13-28(24(31)27-19-10-11-21(25)22(26)15-19)16-23(30)29-14-12-18-8-5-6-9-20(18)17(29)2/h5-6,8-11,15,17H,3-4,7,12-14,16H2,1-2H3,(H,27,31)