N-[(2-methylquinolin-5-yl)carbamothioyl]pentanamide

Systemtic Name: N-[(2-methylquinolin-5-yl)carbamothioyl]pentanamide Openeye Name: N-[(2-methyl-5-quinolyl)carbamothioyl]pentanamide CAS Name: N-[[(2-methyl-5-quinolinyl)amino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(2-methylquinolin-5-yl)carbamothioyl]pentanamide Traditional Name: N-[(2-methyl-5-quinolyl)thiocarbamoyl]valeramide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC2=C1C=CC(=N2)C

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC2=C1C=CC(=N2)C

InChI

InChI=1S/C16H19N3OS/c1-3-4-8-15(20)19-16(21)18-14-7-5-6-13-12(14)10-9-11(2)17-13/h5-7,9-10H,3-4,8H2,1-2H3,(H2,18,19,20,21)