1-isoquinolin-5-yl-3-phenethyl-urea

Systemtic Name: 1-isoquinolin-5-yl-3-phenethyl-urea Openeye Name: 1-(5-isoquinolyl)-3-phenethyl-urea CAS Name: 1-(5-isoquinolinyl)-3-phenethylurea IUPAC Name: 1-isoquinolin-5-yl-3-phenethylurea Traditional Name: 1-(5-isoquinolyl)-3-phenethyl-urea Formula: C18H17N3O MolecularWeight: 291.34708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O/c22-18(20-12-9-14-5-2-1-3-6-14)21-17-8-4-7-15-13-19-11-10-16(15)17/h1-8,10-11,13H,9,12H2,(H2,20,21,22)