2-[(2-bromanyl-4-methyl-phenyl)amino]pyridine-3-carbothioamide

Systemtic Name: 2-[(2-bromanyl-4-methyl-phenyl)amino]pyridine-3-carbothioamide Openeye Name: 2-(2-bromo-4-methyl-anilino)pyridine-3-carbothioamide CAS Name: 2-(2-bromo-4-methylanilino)-3-pyridinecarbothioamide IUPAC Name: 2-(2-bromo-4-methylanilino)pyridine-3-carbothioamide Traditional Name: 2-(2-bromo-4-methyl-anilino)thionicotinamide Formula: C13H12BrN3S MolecularWeight: 322.22348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C=CC=N2)C(=S)N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C=CC=N2)C(=S)N)Br

InChI

InChI=1S/C13H12BrN3S/c1-8-4-5-11(10(14)7-8)17-13-9(12(15)18)3-2-6-16-13/h2-7H,1H3,(H2,15,18)(H,16,17)