[7-chloranyl-2-[2-(methylamino)pyrimidin-5-yl]quinolin-4-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [7-chloranyl-2-[2-(methylamino)pyrimidin-5-yl]quinolin-4-yl]-thiomorpholin-4-yl-methanone Openeye Name: [7-chloro-2-[2-(methylamino)pyrimidin-5-yl]-4-quinolyl]-thiomorpholino-methanone CAS Name: [7-chloro-2-[2-(methylamino)-5-pyrimidinyl]-4-quinolinyl]-thiomorpholin-4-ylmethanone IUPAC Name: [7-chloro-2-[2-(methylamino)pyrimidin-5-yl]quinolin-4-yl]-thiomorpholin-4-ylmethanone Traditional Name: [7-chloro-2-[2-(methylamino)pyrimidin-5-yl]-4-quinolyl]-thiomorpholino-methanone Formula: C19H18ClN5OS MolecularWeight: 399.89712

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(C=N1)C2=NC3=C(C=CC(=C3)Cl)C(=C2)C(=O)N4CCSCC4

Isomeric SMILES

CNC1=NC=C(C=N1)C2=NC3=C(C=CC(=C3)Cl)C(=C2)C(=O)N4CCSCC4

InChI

InChI=1S/C19H18ClN5OS/c1-21-19-22-10-12(11-23-19)16-9-15(18(26)25-4-6-27-7-5-25)14-3-2-13(20)8-17(14)24-16/h2-3,8-11H,4-7H2,1H3,(H,21,22,23)