ethane; N-phenyl-2-thiomorpholin-4-yl-quinoline-4-carboxamide

Systemtic Name: ethane; N-phenyl-2-thiomorpholin-4-yl-quinoline-4-carboxamide Openeye Name: ethane; N-phenyl-2-thiomorpholino-quinoline-4-carboxamide CAS Name: ethane; N-phenyl-2-thiomorpholin-4-yl-4-quinolinecarboxamide IUPAC Name: ethane; N-phenyl-2-thiomorpholin-4-ylquinoline-4-carboxamide Traditional Name: ethane; N-phenyl-2-thiomorpholino-cinchoninamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC.C1CSCCN1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC.C1CSCCN1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H19N3OS.C2H6/c24-20(21-15-6-2-1-3-7-15)17-14-19(23-10-12-25-13-11-23)22-18-9-5-4-8-16(17)18;1-2/h1-9,14H,10-13H2,(H,21,24);1-2H3