1-[(2,5-dimethoxyphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]urea

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]urea Openeye Name: 1-[(2,5-dimethoxyphenyl)methyl]-3-(2-isobutyl-1-oxo-4-isoquinolyl)urea CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxo-4-isoquinolinyl]urea IUPAC Name: 1-[(2,5-dimethoxyphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxoisoquinolin-4-yl]urea Traditional Name: 1-(2,5-dimethoxybenzyl)-3-(2-isobutyl-1-keto-4-isoquinolyl)urea Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC=CC=C2C1=O)NC(=O)NCC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC(C)CN1C=C(C2=CC=CC=C2C1=O)NC(=O)NCC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C23H27N3O4/c1-15(2)13-26-14-20(18-7-5-6-8-19(18)22(26)27)25-23(28)24-12-16-11-17(29-3)9-10-21(16)30-4/h5-11,14-15H,12-13H2,1-4H3,(H2,24,25,28)