1-(3,4-dichlorophenyl)-3-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-piperidin-1-yl-phenyl]urea

Systemtic Name: 1-(3,4-dichlorophenyl)-3-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-piperidin-1-yl-phenyl]urea Openeye Name: 1-(3,4-dichlorophenyl)-3-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-(1-piperidyl)phenyl]urea CAS Name: 1-(3,4-dichlorophenyl)-3-[5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-(1-piperidinyl)phenyl]urea IUPAC Name: 1-(3,4-dichlorophenyl)-3-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-piperidin-1-ylphenyl]urea Traditional Name: 1-(3,4-dichlorophenyl)-3-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-piperidino-phenyl]urea Formula: C28H28Cl2N4O2 MolecularWeight: 523.45352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)NC(=O)NC5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)NC(=O)NC5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C28H28Cl2N4O2/c29-23-10-9-22(17-24(23)30)31-28(36)32-25-16-20(8-11-26(25)33-13-4-1-5-14-33)27(35)34-15-12-19-6-2-3-7-21(19)18-34/h2-3,6-11,16-17H,1,4-5,12-15,18H2,(H2,31,32,36)