1-[1-(4-tert-butylphenyl)ethyl]-3-isoquinolin-5-yl-urea

Systemtic Name: 1-[1-(4-tert-butylphenyl)ethyl]-3-isoquinolin-5-yl-urea Openeye Name: 1-[1-(4-tert-butylphenyl)ethyl]-3-(5-isoquinolyl)urea CAS Name: 1-[1-(4-tert-butylphenyl)ethyl]-3-(5-isoquinolinyl)urea IUPAC Name: 1-[1-(4-tert-butylphenyl)ethyl]-3-isoquinolin-5-ylurea Traditional Name: 1-[1-(4-tert-butylphenyl)ethyl]-3-(5-isoquinolyl)urea Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O/c1-15(16-8-10-18(11-9-16)22(2,3)4)24-21(26)25-20-7-5-6-17-14-23-13-12-19(17)20/h5-15H,1-4H3,(H2,24,25,26)