N-(2-methylquinolin-4-yl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(2-methylquinolin-4-yl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(2-methyl-4-quinolyl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(2-methyl-4-quinolinyl)-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(2-methylquinolin-4-yl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(2-methyl-4-quinolyl)-3-(2-pyrimidylthio)propionamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)CCSC3=NC=CC=N3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)CCSC3=NC=CC=N3

InChI

InChI=1S/C17H16N4OS/c1-12-11-15(13-5-2-3-6-14(13)20-12)21-16(22)7-10-23-17-18-8-4-9-19-17/h2-6,8-9,11H,7,10H2,1H3,(H,20,21,22)