N-(4-bromanyl-3-methyl-phenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-(4-pyridylmethylthio)nicotinamide Formula: C19H16BrN3OS MolecularWeight: 414.31884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3)Br

InChI

InChI=1S/C19H16BrN3OS/c1-13-11-15(4-5-17(13)20)23-18(24)16-3-2-8-22-19(16)25-12-14-6-9-21-10-7-14/h2-11H,12H2,1H3,(H,23,24)