N-(3,4-dichlorophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(3,4-dichlorophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(3,4-dichlorophenyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(3,4-dichlorophenyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(3,4-dichlorophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(3,4-dichlorophenyl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]butyramide Formula: C22H22Cl2N2OS MolecularWeight: 433.39388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)Cl)Cl)SC2=NC3=C(C=C(C=C3C(=C2)C)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)Cl)Cl)SC2=NC3=C(C=C(C=C3C(=C2)C)C)C

InChI

InChI=1S/C22H22Cl2N2OS/c1-5-19(22(27)25-15-6-7-17(23)18(24)11-15)28-20-10-13(3)16-9-12(2)8-14(4)21(16)26-20/h6-11,19H,5H2,1-4H3,(H,25,27)