3-[(7-chloranylquinolin-4-yl)-methyl-amino]propanethioamide

Systemtic Name: 3-[(7-chloranylquinolin-4-yl)-methyl-amino]propanethioamide Openeye Name: 3-[(7-chloro-4-quinolyl)-methyl-amino]propanethioamide CAS Name: 3-[(7-chloro-4-quinolinyl)-methylamino]propanethioamide IUPAC Name: 3-[(7-chloroquinolin-4-yl)-methylamino]propanethioamide Traditional Name: 3-[(7-chloro-4-quinolyl)-methyl-amino]thiopropionamide Formula: C13H14ClN3S MolecularWeight: 279.78836

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)C1=C2C=CC(=CC2=NC=C1)Cl

Isomeric SMILES

CN(CCC(=S)N)C1=C2C=CC(=CC2=NC=C1)Cl

InChI

InChI=1S/C13H14ClN3S/c1-17(7-5-13(15)18)12-4-6-16-11-8-9(14)2-3-10(11)12/h2-4,6,8H,5,7H2,1H3,(H2,15,18)