1-[2-(2,4-dimethylphenyl)ethyl]-3-isoquinolin-5-yl-urea

Systemtic Name: 1-[2-(2,4-dimethylphenyl)ethyl]-3-isoquinolin-5-yl-urea Openeye Name: 1-[2-(2,4-dimethylphenyl)ethyl]-3-(5-isoquinolyl)urea CAS Name: 1-[2-(2,4-dimethylphenyl)ethyl]-3-(5-isoquinolinyl)urea IUPAC Name: 1-[2-(2,4-dimethylphenyl)ethyl]-3-isoquinolin-5-ylurea Traditional Name: 1-[2-(2,4-dimethylphenyl)ethyl]-3-(5-isoquinolyl)urea Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCNC(=O)NC2=CC=CC3=C2C=CN=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCNC(=O)NC2=CC=CC3=C2C=CN=C3)C

InChI

InChI=1S/C20H21N3O/c1-14-6-7-16(15(2)12-14)8-11-22-20(24)23-19-5-3-4-17-13-21-10-9-18(17)19/h3-7,9-10,12-13H,8,11H2,1-2H3,(H2,22,23,24)