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

Systemtic Name: 1-[2-(4-chlorophenyl)ethyl]-3-isoquinolin-5-yl-urea Openeye Name: 1-[2-(4-chlorophenyl)ethyl]-3-(5-isoquinolyl)urea CAS Name: 1-[2-(4-chlorophenyl)ethyl]-3-(5-isoquinolinyl)urea IUPAC Name: 1-[2-(4-chlorophenyl)ethyl]-3-isoquinolin-5-ylurea Traditional Name: 1-[2-(4-chlorophenyl)ethyl]-3-(5-isoquinolyl)urea Formula: C18H16ClN3O MolecularWeight: 325.79214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O/c19-15-6-4-13(5-7-15)8-11-21-18(23)22-17-3-1-2-14-12-20-10-9-16(14)17/h1-7,9-10,12H,8,11H2,(H2,21,22,23)