3-chloranyl-N-(2,2,4,6-tetramethylquinolin-1-yl)carbothioyl-benzamide

Systemtic Name: 3-chloranyl-N-(2,2,4,6-tetramethylquinolin-1-yl)carbothioyl-benzamide Openeye Name: 3-chloro-N-(2,2,4,6-tetramethylquinoline-1-carbothioyl)benzamide CAS Name: 3-chloro-N-[sulfanylidene-(2,2,4,6-tetramethyl-1-quinolinyl)methyl]benzamide IUPAC Name: 3-chloro-N-(2,2,4,6-tetramethylquinoline-1-carbothioyl)benzamide Traditional Name: 3-chloro-N-(2,2,4,6-tetramethylquinoline-1-carbothioyl)benzamide Formula: C21H21ClN2OS MolecularWeight: 384.92224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=S)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=S)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2OS/c1-13-8-9-18-17(10-13)14(2)12-21(3,4)24(18)20(26)23-19(25)15-6-5-7-16(22)11-15/h5-12H,1-4H3,(H,23,25,26)