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

Systemtic Name: 1-isoquinolin-5-yl-3-[2-(4-methoxyphenyl)-2-pyridin-3-yl-ethyl]urea Openeye Name: 1-(5-isoquinolyl)-3-[2-(4-methoxyphenyl)-2-(3-pyridyl)ethyl]urea CAS Name: 1-(5-isoquinolinyl)-3-[2-(4-methoxyphenyl)-2-(3-pyridinyl)ethyl]urea IUPAC Name: 1-isoquinolin-5-yl-3-[2-(4-methoxyphenyl)-2-pyridin-3-ylethyl]urea Traditional Name: 1-(5-isoquinolyl)-3-[2-(4-methoxyphenyl)-2-(3-pyridyl)ethyl]urea Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)NC2=CC=CC3=C2C=CN=C3)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)NC2=CC=CC3=C2C=CN=C3)C4=CN=CC=C4

InChI

InChI=1S/C24H22N4O2/c1-30-20-9-7-17(8-10-20)22(19-5-3-12-25-15-19)16-27-24(29)28-23-6-2-4-18-14-26-13-11-21(18)23/h2-15,22H,16H2,1H3,(H2,27,28,29)