4-bromanyl-N-(2,2,4-trimethylquinolin-1-yl)carbothioyl-benzamide

Systemtic Name: 4-bromanyl-N-(2,2,4-trimethylquinolin-1-yl)carbothioyl-benzamide Openeye Name: 4-bromo-N-(2,2,4-trimethylquinoline-1-carbothioyl)benzamide CAS Name: 4-bromo-N-[sulfanylidene-(2,2,4-trimethyl-1-quinolinyl)methyl]benzamide IUPAC Name: 4-bromo-N-(2,2,4-trimethylquinoline-1-carbothioyl)benzamide Traditional Name: 4-bromo-N-(2,2,4-trimethylquinoline-1-carbothioyl)benzamide Formula: C20H19BrN2OS MolecularWeight: 415.34666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=CC=CC=C12)C(=S)NC(=O)C3=CC=C(C=C3)Br)(C)C

Isomeric SMILES

CC1=CC(N(C2=CC=CC=C12)C(=S)NC(=O)C3=CC=C(C=C3)Br)(C)C

InChI

InChI=1S/C20H19BrN2OS/c1-13-12-20(2,3)23(17-7-5-4-6-16(13)17)19(25)22-18(24)14-8-10-15(21)11-9-14/h4-12H,1-3H3,(H,22,24,25)