4-(3,6-dimethylquinolin-2-yl)sulfanyl-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-(3,6-dimethylquinolin-2-yl)sulfanyl-3-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-[(3,6-dimethyl-2-quinolyl)sulfanyl]-3-oxo-N-phenyl-butanamide CAS Name: 4-[(3,6-dimethyl-2-quinolinyl)thio]-3-oxo-N-phenylbutanamide IUPAC Name: 4-(3,6-dimethylquinolin-2-yl)sulfanyl-3-oxo-N-phenylbutanamide Traditional Name: 4-[(3,6-dimethyl-2-quinolyl)thio]-3-keto-N-phenyl-butyramide Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)SCC(=O)CC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)SCC(=O)CC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H20N2O2S/c1-14-8-9-19-16(10-14)11-15(2)21(23-19)26-13-18(24)12-20(25)22-17-6-4-3-5-7-17/h3-11H,12-13H2,1-2H3,(H,22,25)