4-[(7-chloranylquinolin-2-yl)methoxy]-2-[2-(2-cyanophenyl)sulfanylphenyl]benzamide

Systemtic Name: 4-[(7-chloranylquinolin-2-yl)methoxy]-2-[2-(2-cyanophenyl)sulfanylphenyl]benzamide Openeye Name: 4-[(7-chloro-2-quinolyl)methoxy]-2-[2-(2-cyanophenyl)sulfanylphenyl]benzamide CAS Name: 4-[(7-chloro-2-quinolinyl)methoxy]-2-[2-[(2-cyanophenyl)thio]phenyl]benzamide IUPAC Name: 4-[(7-chloroquinolin-2-yl)methoxy]-2-[2-(2-cyanophenyl)sulfanylphenyl]benzamide Traditional Name: 4-[(7-chloro-2-quinolyl)methoxy]-2-[2-[(2-cyanophenyl)thio]phenyl]benzamide Formula: C30H20ClN3O2S MolecularWeight: 522.0167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C3=C(C=CC(=C3)OCC4=NC5=C(C=CC(=C5)Cl)C=C4)C(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C3=C(C=CC(=C3)OCC4=NC5=C(C=CC(=C5)Cl)C=C4)C(=O)N

InChI

InChI=1S/C30H20ClN3O2S/c31-21-11-9-19-10-12-22(34-27(19)15-21)18-36-23-13-14-25(30(33)35)26(16-23)24-6-2-4-8-29(24)37-28-7-3-1-5-20(28)17-32/h1-16H,18H2,(H2,33,35)