N-isoquinolin-6-yl-2-[(3-phenylsulfanylphenyl)amino]ethanamide

Systemtic Name: N-isoquinolin-6-yl-2-[(3-phenylsulfanylphenyl)amino]ethanamide Openeye Name: N-(6-isoquinolyl)-2-(3-phenylsulfanylanilino)acetamide CAS Name: N-(6-isoquinolinyl)-2-[3-(phenylthio)anilino]acetamide IUPAC Name: N-isoquinolin-6-yl-2-(3-phenylsulfanylanilino)acetamide Traditional Name: N-(6-isoquinolyl)-2-[3-(phenylthio)anilino]acetamide Formula: C23H19N3OS MolecularWeight: 385.48146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC(=C2)NCC(=O)NC3=CC4=C(C=C3)C=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC(=C2)NCC(=O)NC3=CC4=C(C=C3)C=NC=C4

InChI

InChI=1S/C23H19N3OS/c27-23(26-20-10-9-18-15-24-12-11-17(18)13-20)16-25-19-5-4-8-22(14-19)28-21-6-2-1-3-7-21/h1-15,25H,16H2,(H,26,27)