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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-piperidin-1-ylcarbonyl-phenyl]urea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]urea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-piperidinyl)methyl]phenyl]urea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]urea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]urea Formula: C29H31ClN4O2 MolecularWeight: 503.03504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)N5CCCCC5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)N5CCCCC5)Cl

InChI

InChI=1S/C29H31ClN4O2/c1-20-9-10-24(18-26(20)30)32-29(36)31-23-11-12-27(25(17-23)28(35)33-14-5-2-6-15-33)34-16-13-21-7-3-4-8-22(21)19-34/h3-4,7-12,17-18H,2,5-6,13-16,19H2,1H3,(H2,31,32,36)