1-(4-ethylphenyl)-3-[(5-phenylisoquinolin-8-yl)methyl]urea

Systemtic Name: 1-(4-ethylphenyl)-3-[(5-phenylisoquinolin-8-yl)methyl]urea Openeye Name: 1-(4-ethylphenyl)-3-[(5-phenyl-8-isoquinolyl)methyl]urea CAS Name: 1-(4-ethylphenyl)-3-[(5-phenyl-8-isoquinolinyl)methyl]urea IUPAC Name: 1-(4-ethylphenyl)-3-[(5-phenylisoquinolin-8-yl)methyl]urea Traditional Name: 1-(4-ethylphenyl)-3-[(5-phenyl-8-isoquinolyl)methyl]urea Formula: C25H23N3O MolecularWeight: 381.46962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O/c1-2-18-8-11-21(12-9-18)28-25(29)27-16-20-10-13-22(19-6-4-3-5-7-19)23-14-15-26-17-24(20)23/h3-15,17H,2,16H2,1H3,(H2,27,28,29)