3-methyl-N-[(2-methylquinolin-8-yl)carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[(2-methylquinolin-8-yl)carbamothioyl]butanamide Openeye Name: 3-methyl-N-[(2-methyl-8-quinolyl)carbamothioyl]butanamide CAS Name: 3-methyl-N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[(2-methylquinolin-8-yl)carbamothioyl]butanamide Traditional Name: 3-methyl-N-[(2-methyl-8-quinolyl)thiocarbamoyl]butyramide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)CC(C)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)CC(C)C)C=C1

InChI

InChI=1S/C16H19N3OS/c1-10(2)9-14(20)19-16(21)18-13-6-4-5-12-8-7-11(3)17-15(12)13/h4-8,10H,9H2,1-3H3,(H2,18,19,20,21)