N-[4-[6-azanyl-5-cyano-4-(4-methylsulfanylphenyl)pyridin-2-yl]-2-bromanyl-phenyl]ethanamide

Systemtic Name: N-[4-[6-azanyl-5-cyano-4-(4-methylsulfanylphenyl)pyridin-2-yl]-2-bromanyl-phenyl]ethanamide Openeye Name: N-[4-[6-amino-5-cyano-4-(4-methylsulfanylphenyl)-2-pyridyl]-2-bromo-phenyl]acetamide CAS Name: N-[4-[6-amino-5-cyano-4-[4-(methylthio)phenyl]-2-pyridinyl]-2-bromophenyl]acetamide IUPAC Name: N-[4-[6-amino-5-cyano-4-(4-methylsulfanylphenyl)pyridin-2-yl]-2-bromophenyl]acetamide Traditional Name: N-[4-[6-amino-5-cyano-4-[4-(methylthio)phenyl]-2-pyridyl]-2-bromo-phenyl]acetamide Formula: C21H17BrN4OS MolecularWeight: 453.35488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)SC)C#N)N)Br

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)SC)C#N)N)Br

InChI

InChI=1S/C21H17BrN4OS/c1-12(27)25-19-8-5-14(9-18(19)22)20-10-16(17(11-23)21(24)26-20)13-3-6-15(28-2)7-4-13/h3-10H,1-2H3,(H2,24,26)(H,25,27)