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

Systemtic Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-piperidin-1-ylcarbonyl-phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]urea CAS Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-piperidinyl)methyl]phenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]urea Traditional Name: 1-benzyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]urea Formula: C29H32N4O2 MolecularWeight: 468.58998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)NC(=O)NCC3=CC=CC=C3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)NC(=O)NCC3=CC=CC=C3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H32N4O2/c34-28(32-16-7-2-8-17-32)26-19-25(31-29(35)30-20-22-9-3-1-4-10-22)13-14-27(26)33-18-15-23-11-5-6-12-24(23)21-33/h1,3-6,9-14,19H,2,7-8,15-18,20-21H2,(H2,30,31,35)