1-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-3-(4-ethylphenyl)urea

Systemtic Name: 1-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-3-(4-ethylphenyl)urea Openeye Name: 1-[1-benzyl-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-3-(4-ethylphenyl)urea CAS Name: 1-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-3-phenylpropan-2-yl]-3-(4-ethylphenyl)urea IUPAC Name: 1-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-3-phenylpropan-2-yl]-3-(4-ethylphenyl)urea Traditional Name: 1-[1-benzyl-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-3-(4-ethylphenyl)urea Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C29H33N3O4/c1-4-20-10-12-24(13-11-20)30-29(34)31-25(16-21-8-6-5-7-9-21)28(33)32-15-14-22-17-26(35-2)27(36-3)18-23(22)19-32/h5-13,17-18,25H,4,14-16,19H2,1-3H3,(H2,30,31,34)