1-[(3,4-dimethylphenyl)methyl]-3-(3-methylisoquinolin-5-yl)urea

Systemtic Name: 1-[(3,4-dimethylphenyl)methyl]-3-(3-methylisoquinolin-5-yl)urea Openeye Name: 1-[(3,4-dimethylphenyl)methyl]-3-(3-methyl-5-isoquinolyl)urea CAS Name: 1-[(3,4-dimethylphenyl)methyl]-3-(3-methyl-5-isoquinolinyl)urea IUPAC Name: 1-[(3,4-dimethylphenyl)methyl]-3-(3-methylisoquinolin-5-yl)urea Traditional Name: 1-(3,4-dimethylbenzyl)-3-(3-methyl-5-isoquinolyl)urea Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)NC2=CC=CC3=CN=C(C=C32)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)NC2=CC=CC3=CN=C(C=C32)C)C

InChI

InChI=1S/C20H21N3O/c1-13-7-8-16(9-14(13)2)11-22-20(24)23-19-6-4-5-17-12-21-15(3)10-18(17)19/h4-10,12H,11H2,1-3H3,(H2,22,23,24)