N-(2-bromanyl-4-methyl-phenyl)quinoline-2-carbothioamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)quinoline-2-carbothioamide Openeye Name: N-(2-bromo-4-methyl-phenyl)quinoline-2-carbothioamide CAS Name: N-(2-bromo-4-methylphenyl)-2-quinolinecarbothioamide IUPAC Name: N-(2-bromo-4-methylphenyl)quinoline-2-carbothioamide Traditional Name: N-(2-bromo-4-methyl-phenyl)thioquinaldamide Formula: C17H13BrN2S MolecularWeight: 357.26752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)C2=NC3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)C2=NC3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C17H13BrN2S/c1-11-6-8-15(13(18)10-11)20-17(21)16-9-7-12-4-2-3-5-14(12)19-16/h2-10H,1H3,(H,20,21)