1-[(4-methylphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]urea

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]urea Openeye Name: 1-(2-isobutyl-1-oxo-4-isoquinolyl)-3-(p-tolylmethyl)urea CAS Name: 1-[(4-methylphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxo-4-isoquinolinyl]urea IUPAC Name: 1-[(4-methylphenyl)methyl]-3-[2-(2-methylpropyl)-1-oxoisoquinolin-4-yl]urea Traditional Name: 1-(2-isobutyl-1-keto-4-isoquinolyl)-3-(4-methylbenzyl)urea Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)NC2=CN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)NC2=CN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C22H25N3O2/c1-15(2)13-25-14-20(18-6-4-5-7-19(18)21(25)26)24-22(27)23-12-17-10-8-16(3)9-11-17/h4-11,14-15H,12-13H2,1-3H3,(H2,23,24,27)